Molecular properties
- Formula
- C16H13ClN2O
- Molar mass
- 284.75 g·mol−1
- Exact mass
- 284.0716 Da
- 11
- PubChem CID
- 3016
Molecule record
7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one
C16H13ClN2O
284.75 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Amide
Aromatic ring
Aryl halide
Tertiary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 439-14-5
- Alboral
- Ansiolin
- Ansiolisina
- Apaurin
- Apozepam
- Atensine
- Bialzepam
Show all 24 synonyms
- Calmpose
- Cercine
- Ceregulart
- Diazemuls
- Faustan
- Lembrol
- Morosan
- Neurolytril
- Relanium
- Seduxen
- Serenamin
- Sibazon
- Stesolid
- Valium
- Valrelease
- diazepam
Structure identifiers
- Canonical SMILES
- CN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21
- Isomeric SMILES
- CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3
- InChI
- InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
- InChIKey
- AAOVKJBEBIDNHE-UHFFFAOYSA-N
- PubChem CID
- 3016
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.