5-azanyl-2-[2-(3,4-dimethoxyphenyl)ethanoyl]isoindole-1,3-dione

Systemtic Name: 5-azanyl-2-[2-(3,4-dimethoxyphenyl)ethanoyl]isoindole-1,3-dione Openeye Name: 5-amino-2-[2-(3,4-dimethoxyphenyl)acetyl]isoindoline-1,3-dione CAS Name: 5-amino-2-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]isoindole-1,3-dione IUPAC Name: 5-amino-2-[2-(3,4-dimethoxyphenyl)acetyl]isoindole-1,3-dione Traditional Name: 5-amino-2-homoveratroyl-isoindoline-1,3-quinone Formula: C18H16N2O5 MolecularWeight: 340.33004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2C(=O)C3=C(C2=O)C=C(C=C3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2C(=O)C3=C(C2=O)C=C(C=C3)N)OC

InChI

InChI=1S/C18H16N2O5/c1-24-14-6-3-10(7-15(14)25-2)8-16(21)20-17(22)12-5-4-11(19)9-13(12)18(20)23/h3-7,9H,8,19H2,1-2H3