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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=CC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC3=CC=CS3)C(=O)O

InChI

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