3-oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindole-4-carboxylic acid

Systemtic Name: 3-oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindole-4-carboxylic acid Openeye Name: 3-oxo-2-(2-thienylmethyl)isoindoline-4-carboxylic acid CAS Name: 3-oxo-2-(thiophen-2-ylmethyl)-1H-isoindole-4-carboxylic acid IUPAC Name: 3-oxo-2-(thiophen-2-ylmethyl)-1H-isoindole-4-carboxylic acid Traditional Name: 3-keto-2-(2-thenyl)isoindoline-4-carboxylic acid Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC(=C2C(=O)N1CC3=CC=CS3)C(=O)O

Isomeric SMILES

C1C2=CC=CC(=C2C(=O)N1CC3=CC=CS3)C(=O)O

InChI

InChI=1S/C14H11NO3S/c16-13-12-9(3-1-5-11(12)14(17)18)7-15(13)8-10-4-2-6-19-10/h1-6H,7-8H2,(H,17,18)