2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethyl]-7-methoxy-4,4-dimethyl-isoquinoline-1,3-dione

Systemtic Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethyl]-7-methoxy-4,4-dimethyl-isoquinoline-1,3-dione Openeye Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethyl]-7-methoxy-4,4-dimethyl-isoquinoline-1,3-dione CAS Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-7-methoxy-4,4-dimethylisoquinoline-1,3-dione IUPAC Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-7-methoxy-4,4-dimethylisoquinoline-1,3-dione Traditional Name: 2-[2-[homoveratryl(methyl)amino]ethyl]-7-methoxy-4,4-dimethyl-isoquinoline-1,3-quinone Formula: C25H32N2O5 MolecularWeight: 440.53198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)OC)C(=O)N(C1=O)CCN(C)CCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)OC)C(=O)N(C1=O)CCN(C)CCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C25H32N2O5/c1-25(2)20-9-8-18(30-4)16-19(20)23(28)27(24(25)29)14-13-26(3)12-11-17-7-10-21(31-5)22(15-17)32-6/h7-10,15-16H,11-14H2,1-6H3