2-[2-(4-methylsulfanylphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(4-methylsulfanylphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-methylsulfanylphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[2-[4-(methylthio)phenyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(4-methylsulfanylphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-[4-(methylthio)phenyl]-1H-indol-3-yl]acetic acid Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CC(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CC(=O)O

InChI

InChI=1S/C17H15NO2S/c1-21-12-8-6-11(7-9-12)17-14(10-16(19)20)13-4-2-3-5-15(13)18-17/h2-9,18H,10H2,1H3,(H,19,20)