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

Systemtic Name: 7-chloranyl-1'-(phenylmethyl)-5-pyridin-2-yl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Openeye Name: 1'-benzyl-7-chloro-5-(2-pyridyl)spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one CAS Name: 7-chloro-1'-(phenylmethyl)-5-(2-pyridinyl)-2-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]one IUPAC Name: 1'-benzyl-7-chloro-5-pyridin-2-ylspiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Traditional Name: 1'-benzyl-7-chloro-5-(2-pyridyl)spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Formula: C25H23ClN4O MolecularWeight: 430.92932

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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=N4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC12C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=N4)CC5=CC=CC=C5

InChI

InChI=1S/C25H23ClN4O/c26-19-9-10-21-20(16-19)23(22-8-4-5-13-27-22)29-25(24(31)28-21)11-14-30(15-12-25)17-18-6-2-1-3-7-18/h1-10,13,16H,11-12,14-15,17H2,(H,28,31)