7-chloranyl-5-phenyl-1'-(phenylmethyl)spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one

Systemtic Name: 7-chloranyl-5-phenyl-1'-(phenylmethyl)spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Openeye Name: 1'-benzyl-7-chloro-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one CAS Name: 7-chloro-5-phenyl-1'-(phenylmethyl)-2-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]one IUPAC Name: 1'-benzyl-7-chloro-5-phenylspiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Traditional Name: 1'-benzyl-7-chloro-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Formula: C26H24ClN3O MolecularWeight: 429.94126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC12C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H24ClN3O/c27-21-11-12-23-22(17-21)24(20-9-5-2-6-10-20)29-26(25(31)28-23)13-15-30(16-14-26)18-19-7-3-1-4-8-19/h1-12,17H,13-16,18H2,(H,28,31)