2-[5,7-dimethyl-2-(4-methylsulfanylphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5,7-dimethyl-2-(4-methylsulfanylphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5,7-dimethyl-2-(4-methylsulfanylphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5,7-dimethyl-2-[4-(methylthio)phenyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5,7-dimethyl-2-(4-methylsulfanylphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5,7-dimethyl-2-[4-(methylthio)phenyl]-1H-indol-3-yl]acetic acid Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(N2)C3=CC=C(C=C3)SC)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(N2)C3=CC=C(C=C3)SC)CC(=O)O)C

InChI

InChI=1S/C19H19NO2S/c1-11-8-12(2)18-15(9-11)16(10-17(21)22)19(20-18)13-4-6-14(23-3)7-5-13/h4-9,20H,10H2,1-3H3,(H,21,22)