1-methyl-2-oxidanylidene-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-7-carbonitrile

Systemtic Name: 1-methyl-2-oxidanylidene-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-7-carbonitrile Openeye Name: 1-methyl-2-oxo-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-7-carbonitrile CAS Name: 1-methyl-2-oxo-5-phenyl-7-spiro[1,4-benzodiazepine-3,4'-piperidine]carbonitrile IUPAC Name: 1-methyl-2-oxo-5-phenylspiro[1,4-benzodiazepine-3,4'-piperidine]-7-carbonitrile Traditional Name: 2-keto-1-methyl-5-phenyl-spiro[1,4-benzodiazepine-3,4'-piperidine]-7-carbonitrile Formula: C21H20N4O MolecularWeight: 344.4097

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C#N)C(=NC3(C1=O)CCNCC3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)C#N)C(=NC3(C1=O)CCNCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O/c1-25-18-8-7-15(14-22)13-17(18)19(16-5-3-2-4-6-16)24-21(20(25)26)9-11-23-12-10-21/h2-8,13,23H,9-12H2,1H3