3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1H-3-benzazepin-2-one hydrochloride

Systemtic Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1H-3-benzazepin-2-one hydrochloride Openeye Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propyl]-7,8-dimethyl-1H-3-benzazepin-2-one hydrochloride CAS Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-7,8-dimethyl-1H-3-benzazepin-2-one hydrochloride IUPAC Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propyl]-7,8-dimethyl-1H-3-benzazepin-2-one hydrochloride Traditional Name: 3-[3-[homoveratryl(methyl)amino]propyl]-7,8-dimethyl-1H-3-benzazepin-2-one hydrochloride Formula: C26H35ClN2O3 MolecularWeight: 459.0207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CN(C(=O)CC2=C1)CCCN(C)CCC3=CC(=C(C=C3)OC)OC)C.Cl

Isomeric SMILES

CC1=C(C=C2C=CN(C(=O)CC2=C1)CCCN(C)CCC3=CC(=C(C=C3)OC)OC)C.Cl

InChI

InChI=1S/C26H34N2O3.ClH/c1-19-15-22-10-14-28(26(29)18-23(22)16-20(19)2)12-6-11-27(3)13-9-21-7-8-24(30-4)25(17-21)31-5;/h7-8,10,14-17H,6,9,11-13,18H2,1-5H3;1H