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

Systemtic Name: 3-[3-[3-(3,4-dimethoxyphenyl)propyl-methyl-amino]propyl]-7,8-dimethoxy-5-oxidanyl-2,5-dihydro-1H-3-benzazepin-4-one Openeye Name: 3-[3-[3-(3,4-dimethoxyphenyl)propyl-methyl-amino]propyl]-5-hydroxy-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one CAS Name: 3-[3-[3-(3,4-dimethoxyphenyl)propyl-methylamino]propyl]-5-hydroxy-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one IUPAC Name: 3-[3-[3-(3,4-dimethoxyphenyl)propyl-methylamino]propyl]-5-hydroxy-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Traditional Name: 3-[3-[3-(3,4-dimethoxyphenyl)propyl-methyl-amino]propyl]-5-hydroxy-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one Formula: C27H38N2O6 MolecularWeight: 486.60042

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC(=C(C=C1)OC)OC)CCCN2CCC3=CC(=C(C=C3C(C2=O)O)OC)OC

Isomeric SMILES

CN(CCCC1=CC(=C(C=C1)OC)OC)CCCN2CCC3=CC(=C(C=C3C(C2=O)O)OC)OC

InChI

InChI=1S/C27H38N2O6/c1-28(12-6-8-19-9-10-22(32-2)23(16-19)33-3)13-7-14-29-15-11-20-17-24(34-4)25(35-5)18-21(20)26(30)27(29)31/h9-10,16-18,26,30H,6-8,11-15H2,1-5H3