2-[3-oxidanylidene-2-(thiophen-3-ylmethyl)-1H-isoindol-1-yl]ethanoic acid

Systemtic Name: 2-[3-oxidanylidene-2-(thiophen-3-ylmethyl)-1H-isoindol-1-yl]ethanoic acid Openeye Name: 2-[3-oxo-2-(3-thienylmethyl)isoindolin-1-yl]acetic acid CAS Name: 2-[3-oxo-2-(3-thiophenylmethyl)-1H-isoindol-1-yl]acetic acid IUPAC Name: 2-[3-oxo-2-(thiophen-3-ylmethyl)-1H-isoindol-1-yl]acetic acid Traditional Name: 2-[3-keto-2-(3-thenyl)isoindolin-1-yl]acetic acid Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=CSC=C3)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC3=CSC=C3)CC(=O)O

InChI

InChI=1S/C15H13NO3S/c17-14(18)7-13-11-3-1-2-4-12(11)15(19)16(13)8-10-5-6-20-9-10/h1-6,9,13H,7-8H2,(H,17,18)