2-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 2-(homoveratroylamino)-1,3-diketo-isoindoline-5-carboxylic acid Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C19H16N2O7/c1-27-14-6-3-10(7-15(14)28-2)8-16(22)20-21-17(23)12-5-4-11(19(25)26)9-13(12)18(21)24/h3-7,9H,8H2,1-2H3,(H,20,22)(H,25,26)