2-(3-methylsulfanyl-2-phenyl-indol-1-yl)ethanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N(C2=CC=CC=C21)CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CSC1=C(N(C2=CC=CC=C21)CC(=O)O)C3=CC=CC=C3

InChI

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