1-[4-[4-(3,5-dimethylphenyl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione

Systemtic Name: 1-[4-[4-(3,5-dimethylphenyl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione Openeye Name: 1-[4-[4-(3,5-dimethylphenyl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione CAS Name: 1-[4-[4-(3,5-dimethylphenyl)-1-piperazinyl]-1-oxobutyl]-3,4-dihydro-1-benzazepine-2,5-dione IUPAC Name: 1-[4-[4-(3,5-dimethylphenyl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione Traditional Name: 1-[4-[4-(3,5-dimethylphenyl)piperazino]butanoyl]-3,4-dihydro-1-benzazepine-2,5-quinone Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CCN(CC2)CCCC(=O)N3C(=O)CCC(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CCN(CC2)CCCC(=O)N3C(=O)CCC(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C26H31N3O3/c1-19-16-20(2)18-21(17-19)28-14-12-27(13-15-28)11-5-8-25(31)29-23-7-4-3-6-22(23)24(30)9-10-26(29)32/h3-4,6-7,16-18H,5,8-15H2,1-2H3