2-[6-chloranyl-2-(2-methylsulfonylphenyl)carbonyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-2-(2-methylsulfonylphenyl)carbonyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[6-chloro-2-(2-methylsulfonylbenzoyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[6-chloro-2-[(2-methylsulfonylphenyl)-oxomethyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[6-chloro-2-(2-methylsulfonylbenzoyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[6-chloro-2-(2-mesylbenzoyl)-1H-indol-3-yl]acetic acid Formula: C18H14ClNO5S MolecularWeight: 391.82546

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)C2=C(C3=C(N2)C=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)C2=C(C3=C(N2)C=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C18H14ClNO5S/c1-26(24,25)15-5-3-2-4-12(15)18(23)17-13(9-16(21)22)11-7-6-10(19)8-14(11)20-17/h2-8,20H,9H2,1H3,(H,21,22)