2-oxidanylidene-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-8-carbonitrile

Systemtic Name: 2-oxidanylidene-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-8-carbonitrile Openeye Name: 2-oxo-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-8-carbonitrile CAS Name: 2-oxo-5-phenyl-8-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]carbonitrile IUPAC Name: 2-oxo-5-phenylspiro[1H-1,4-benzodiazepine-3,4'-piperidine]-8-carbonitrile Traditional Name: 2-keto-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-8-carbonitrile Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC12C(=O)NC3=C(C=CC(=C3)C#N)C(=N2)C4=CC=CC=C4

Isomeric SMILES

C1CNCCC12C(=O)NC3=C(C=CC(=C3)C#N)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O/c21-13-14-6-7-16-17(12-14)23-19(25)20(8-10-22-11-9-20)24-18(16)15-4-2-1-3-5-15/h1-7,12,22H,8-11H2,(H,23,25)