Molecule record

[1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] benzoate

C23H28N2O3

380.49 g/mol

Loading structure

Molecular properties

Formula
C23H28N2O3
Molar mass
380.49 g·mol−1
Exact mass
380.2100 Da
11
PubChem CID
44112

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ester
Ether
Secondary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • (+-)-1-(tert-Butylamino)-3-((2-methylindol-4-yl)oxy)-2-propanol benzoate (ester)
  • (+-)-4-(2-Benzoyloxy-3-tert-butylaminopropoxy)-2-methylindole
  • (+-)-Bopindolol
  • 1-(tert-butylamino)-3-((2-methylindo)-4-yl)-2-propanol benzoate
  • 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((2-methyl-1H-indol-4-yl)oxy)-, benzoate (ester), (+-)-
  • 2-Propanol, 1-[(1,1-dimethylethyl)amino]-3-[(2-methyl-1H-indol-4-yl)oxy]-, benzoate (ester)
  • 62658-63-3
  • 69010-88-4
Show all 24 synonyms
  • BOPINDOLOL
  • BOPINDOLOL [MI]
  • Bopindolol [INN]
  • Bopindololum
  • Bopindololum [INN-Latin]
  • C07AA17
  • C23H28N2O3
  • CAS-62658-63-3
  • CHEBI:76749
  • DTXCID402684
  • DTXSID6022684
  • KT304VZO57
  • NCGC00163155-01
  • RefChem:569816
  • UNII-KT304VZO57
  • rac Bopindolol

Structure identifiers

Canonical SMILES
Cc1cc2c(OCC(CNC(C)(C)C)OC(=O)c3ccccc3)cccc2[nH]1
Isomeric SMILES
CC1=CC2=C(N1)C=CC=C2OCC(CNC(C)(C)C)OC(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H28N2O3/c1-16-13-19-20(25-16)11-8-12-21(19)27-15-18(14-24-23(2,3)4)28-22(26)17-9-6-5-7-10-17/h5-13,18,24-25H,14-15H2,1-4H3
InChIKey
UUOJIACWOAYWEZ-UHFFFAOYSA-N
PubChem CID
44112

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for [1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] benzoate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for [1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl] benzoate; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record