3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-6,9-dimethoxy-1H-3-benzazepin-2-one

Systemtic Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-6,9-dimethoxy-1H-3-benzazepin-2-one Openeye Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-6,9-dimethoxy-1H-3-benzazepin-2-one CAS Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-6,9-dimethoxy-1H-3-benzazepin-2-one IUPAC Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-6,9-dimethoxy-1H-3-benzazepin-2-one Traditional Name: 3-[3-[homoveratryl(methyl)amino]propyl]-6,9-dimethoxy-1H-3-benzazepin-2-one Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C=CC2=C(C=CC(=C2CC1=O)OC)OC)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCCN1C=CC2=C(C=CC(=C2CC1=O)OC)OC)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H34N2O5/c1-27(15-11-19-7-8-24(32-4)25(17-19)33-5)13-6-14-28-16-12-20-21(18-26(28)29)23(31-3)10-9-22(20)30-2/h7-10,12,16-17H,6,11,13-15,18H2,1-5H3