7,8-dimethoxy-3-[3-(3-phenylazanylpropylamino)propyl]-1,2-dihydro-3-benzazepine-4,5-dione

Systemtic Name: 7,8-dimethoxy-3-[3-(3-phenylazanylpropylamino)propyl]-1,2-dihydro-3-benzazepine-4,5-dione Openeye Name: 3-[3-(3-anilinopropylamino)propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione CAS Name: 3-[3-(3-anilinopropylamino)propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione IUPAC Name: 3-[3-(3-anilinopropylamino)propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-dione Traditional Name: 3-[3-(3-anilinopropylamino)propyl]-7,8-dimethoxy-1,2-dihydro-3-benzazepine-4,5-quinone Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN(C(=O)C2=O)CCCNCCCNC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN(C(=O)C2=O)CCCNCCCNC3=CC=CC=C3)OC

InChI

InChI=1S/C24H31N3O4/c1-30-21-16-18-10-15-27(24(29)23(28)20(18)17-22(21)31-2)14-7-12-25-11-6-13-26-19-8-4-3-5-9-19/h3-5,8-9,16-17,25-26H,6-7,10-15H2,1-2H3