2-[1-(4-chlorophenyl)sulfonyl-5-cyano-2-methyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)sulfonyl-5-cyano-2-methyl-indol-3-yl]ethanoic acid Openeye Name: 2-[1-(4-chlorophenyl)sulfonyl-5-cyano-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[1-(4-chlorophenyl)sulfonyl-5-cyano-2-methyl-3-indolyl]acetic acid IUPAC Name: 2-[1-(4-chlorophenyl)sulfonyl-5-cyano-2-methylindol-3-yl]acetic acid Traditional Name: 2-[1-(4-chlorophenyl)sulfonyl-5-cyano-2-methyl-indol-3-yl]acetic acid Formula: C18H13ClN2O4S MolecularWeight: 388.82482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1S(=O)(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)C#N)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1S(=O)(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)C#N)CC(=O)O

InChI

InChI=1S/C18H13ClN2O4S/c1-11-15(9-18(22)23)16-8-12(10-20)2-7-17(16)21(11)26(24,25)14-5-3-13(19)4-6-14/h2-8H,9H2,1H3,(H,22,23)