2-[2-(1H-indol-3-ylsulfanyl)phenyl]ethanoic acid

Systemtic Name: 2-[2-(1H-indol-3-ylsulfanyl)phenyl]ethanoic acid Openeye Name: 2-[2-(1H-indol-3-ylsulfanyl)phenyl]acetic acid CAS Name: 2-[2-(1H-indol-3-ylthio)phenyl]acetic acid IUPAC Name: 2-[2-(1H-indol-3-ylsulfanyl)phenyl]acetic acid Traditional Name: 2-[2-(1H-indol-3-ylthio)phenyl]acetic acid Formula: C16H13NO2S MolecularWeight: 283.34492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)O)SC2=CNC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)O)SC2=CNC3=CC=CC=C32

InChI

InChI=1S/C16H13NO2S/c18-16(19)9-11-5-1-4-8-14(11)20-15-10-17-13-7-3-2-6-12(13)15/h1-8,10,17H,9H2,(H,18,19)