7,8-dimethoxy-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one

Systemtic Name: 7,8-dimethoxy-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Openeye Name: 7,8-dimethoxy-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one CAS Name: 7,8-dimethoxy-5-phenyl-2-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]one IUPAC Name: 7,8-dimethoxy-5-phenylspiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Traditional Name: 7,8-dimethoxy-5-phenyl-spiro[1H-1,4-benzodiazepine-3,4'-piperidine]-2-one Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC3(CCNCC3)C(=O)N2)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC3(CCNCC3)C(=O)N2)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H23N3O3/c1-26-17-12-15-16(13-18(17)27-2)23-20(25)21(8-10-22-11-9-21)24-19(15)14-6-4-3-5-7-14/h3-7,12-13,22H,8-11H2,1-2H3,(H,23,25)