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

Systemtic Name: 3-[3-[2-(1,3-benzodioxol-5-yl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Openeye Name: 3-[3-[2-(1,3-benzodioxol-5-yl)ethyl-methyl-amino]propyl]-7,8-dimethoxy-1H-3-benzazepin-2-one CAS Name: 3-[3-[2-(1,3-benzodioxol-5-yl)ethyl-methylamino]propyl]-7,8-dimethoxy-1H-3-benzazepin-2-one IUPAC Name: 3-[3-[2-(1,3-benzodioxol-5-yl)ethyl-methylamino]propyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Traditional Name: 3-[3-[homopiperonyl(methyl)amino]propyl]-7,8-dimethoxy-1H-3-benzazepin-2-one Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1C=CC2=CC(=C(C=C2CC1=O)OC)OC)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(CCCN1C=CC2=CC(=C(C=C2CC1=O)OC)OC)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H30N2O5/c1-26(11-7-18-5-6-21-24(13-18)32-17-31-21)9-4-10-27-12-8-19-14-22(29-2)23(30-3)15-20(19)16-25(27)28/h5-6,8,12-15H,4,7,9-11,16-17H2,1-3H3