3-[(3-oxidanylidene-1-pyrrol-1-yl-1H-isoindol-2-yl)methyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-oxidanylidene-1-pyrrol-1-yl-1H-isoindol-2-yl)methyl]thiophene-2-carboxylic acid Openeye Name: 3-[(1-oxo-3-pyrrol-1-yl-isoindolin-2-yl)methyl]thiophene-2-carboxylic acid CAS Name: 3-[[3-oxo-1-(1-pyrrolyl)-1H-isoindol-2-yl]methyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-oxo-1-pyrrol-1-yl-1H-isoindol-2-yl)methyl]thiophene-2-carboxylic acid Traditional Name: 3-[(1-keto-3-pyrrol-1-yl-isoindolin-2-yl)methyl]-2-thenoic acid Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=C(SC=C3)C(=O)O)N4C=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC3=C(SC=C3)C(=O)O)N4C=CC=C4

InChI

InChI=1S/C18H14N2O3S/c21-17-14-6-2-1-5-13(14)16(19-8-3-4-9-19)20(17)11-12-7-10-24-15(12)18(22)23/h1-10,16H,11H2,(H,22,23)