(phenylmethyl) 5-methyl-2-oxidanylidene-spiro[4H-1,4-benzodiazepine-3,4'-piperidine]-1'-carboxylate

Systemtic Name: (phenylmethyl) 5-methyl-2-oxidanylidene-spiro[4H-1,4-benzodiazepine-3,4'-piperidine]-1'-carboxylate Openeye Name: benzyl 5-methyl-2-oxo-spiro[4H-1,4-benzodiazepine-3,4'-piperidine]-1'-carboxylate CAS Name: 5-methyl-2-oxo-1'-spiro[4H-1,4-benzodiazepine-3,4'-piperidine]carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-2-oxospiro[4H-1,4-benzodiazepine-3,4'-piperidine]-1'-carboxylate Traditional Name: 2-keto-5-methyl-spiro[4H-1,4-benzodiazepine-3,4'-piperidine]-1'-carboxylic acid benzyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=NC(=O)C3(N1)CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C=CC=CC2=NC(=O)C3(N1)CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O3/c1-16-18-9-5-6-10-19(18)23-20(26)22(24-16)11-13-25(14-12-22)21(27)28-15-17-7-3-2-4-8-17/h2-10,24H,11-15H2,1H3