7,8-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-1-benzazepine-2,5-dione

Systemtic Name: 7,8-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-1-benzazepine-2,5-dione Openeye Name: 7,8-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-1-benzazepine-2,5-dione CAS Name: 7,8-dimethyl-4-[(4-methyl-1-piperazinyl)methyl]-1H-1-benzazepine-2,5-dione IUPAC Name: 7,8-dimethyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-1-benzazepine-2,5-dione Traditional Name: 7,8-dimethyl-4-[(4-methylpiperazino)methyl]-1H-1-benzazepine-2,5-quinone Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=CC(=O)N2)CN3CCN(CC3)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=CC(=O)N2)CN3CCN(CC3)C)C

InChI

InChI=1S/C18H23N3O2/c1-12-8-15-16(9-13(12)2)19-17(22)10-14(18(15)23)11-21-6-4-20(3)5-7-21/h8-10H,4-7,11H2,1-3H3,(H,19,22)