3-[3-[2-(3,4-dimethylphenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one

Systemtic Name: 3-[3-[2-(3,4-dimethylphenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[2-(3,4-dimethylphenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[2-(3,4-dimethylphenyl)ethyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[2-(3,4-dimethylphenyl)ethyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[2-(3,4-dimethylphenyl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCN(C)CCCN2CCC3=CC(=C(C=C3CC2=O)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)CCN(C)CCCN2CCC3=CC(=C(C=C3CC2=O)OC)OC)C

InChI

InChI=1S/C26H36N2O3/c1-19-7-8-21(15-20(19)2)9-13-27(3)11-6-12-28-14-10-22-16-24(30-4)25(31-5)17-23(22)18-26(28)29/h7-8,15-17H,6,9-14,18H2,1-5H3