2-(3-methoxyphenyl)-3-oxidanylidene-1-prop-2-enyl-1H-isoindole-4-carboxylic acid

Systemtic Name: 2-(3-methoxyphenyl)-3-oxidanylidene-1-prop-2-enyl-1H-isoindole-4-carboxylic acid Openeye Name: 1-allyl-2-(3-methoxyphenyl)-3-oxo-isoindoline-4-carboxylic acid CAS Name: 2-(3-methoxyphenyl)-3-oxo-1-prop-2-enyl-1H-isoindole-4-carboxylic acid IUPAC Name: 2-(3-methoxyphenyl)-3-oxo-1-prop-2-enyl-1H-isoindole-4-carboxylic acid Traditional Name: 1-allyl-3-keto-2-(3-methoxyphenyl)isoindoline-4-carboxylic acid Formula: C19H17NO4 MolecularWeight: 323.34258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(C3=CC=CC(=C3C2=O)C(=O)O)CC=C

Isomeric SMILES

COC1=CC=CC(=C1)N2C(C3=CC=CC(=C3C2=O)C(=O)O)CC=C

InChI

InChI=1S/C19H17NO4/c1-3-6-16-14-9-5-10-15(19(22)23)17(14)18(21)20(16)12-7-4-8-13(11-12)24-2/h3-5,7-11,16H,1,6H2,2H3,(H,22,23)