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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)SCC(=O)O

InChI

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