5-chloranyl-1-[4-(trifluoromethyl)phenyl]sulfonyl-indole-3-carboxylic acid

Systemtic Name: 5-chloranyl-1-[4-(trifluoromethyl)phenyl]sulfonyl-indole-3-carboxylic acid Openeye Name: 5-chloro-1-[4-(trifluoromethyl)phenyl]sulfonyl-indole-3-carboxylic acid CAS Name: 5-chloro-1-[4-(trifluoromethyl)phenyl]sulfonyl-3-indolecarboxylic acid IUPAC Name: 5-chloro-1-[4-(trifluoromethyl)phenyl]sulfonylindole-3-carboxylic acid Traditional Name: 5-chloro-1-[4-(trifluoromethyl)phenyl]sulfonyl-indole-3-carboxylic acid Formula: C16H9ClF3NO4S MolecularWeight: 403.76017

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)C(=O)O

InChI

InChI=1S/C16H9ClF3NO4S/c17-10-3-6-14-12(7-10)13(15(22)23)8-21(14)26(24,25)11-4-1-9(2-5-11)16(18,19)20/h1-8H,(H,22,23)