4-[1-(3,4-dimethoxyphenyl)-3-oxidanyl-propyl]isoindole-1,3-dione

Systemtic Name: 4-[1-(3,4-dimethoxyphenyl)-3-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 4-[1-(3,4-dimethoxyphenyl)-3-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 4-[1-(3,4-dimethoxyphenyl)-3-hydroxypropyl]isoindole-1,3-dione IUPAC Name: 4-[1-(3,4-dimethoxyphenyl)-3-hydroxypropyl]isoindole-1,3-dione Traditional Name: 4-[1-(3,4-dimethoxyphenyl)-3-hydroxy-propyl]isoindoline-1,3-quinone Formula: C19H19NO5 MolecularWeight: 341.35786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCO)C2=CC=CC3=C2C(=O)NC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCO)C2=CC=CC3=C2C(=O)NC3=O)OC

InChI

InChI=1S/C19H19NO5/c1-24-15-7-6-11(10-16(15)25-2)12(8-9-21)13-4-3-5-14-17(13)19(23)20-18(14)22/h3-7,10,12,21H,8-9H2,1-2H3,(H,20,22,23)