2-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-homoveratryl-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C19H23NO4 MolecularWeight: 329.39022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C(C1)C(=O)N(C2=O)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CCC2C(C1)C(=O)N(C2=O)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C19H23NO4/c1-12-4-6-14-15(10-12)19(22)20(18(14)21)9-8-13-5-7-16(23-2)17(11-13)24-3/h4-5,7,11,14-15H,6,8-10H2,1-3H3