8-chloranyl-6-[(phenylmethyl)sulfamoyl]-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 8-chloranyl-6-[(phenylmethyl)sulfamoyl]-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-(benzylsulfamoyl)-8-chloro-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 8-chloro-6-[(phenylmethyl)sulfamoyl]-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-(benzylsulfamoyl)-8-chloro-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-(benzylsulfamoyl)-8-chloro-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C18H15ClF3NO5S MolecularWeight: 449.82861

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C(C=C(C=C21)S(=O)(=O)NCC3=CC=CC=C3)Cl)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C(C=C(C=C21)S(=O)(=O)NCC3=CC=CC=C3)Cl)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H15ClF3NO5S/c19-14-8-12(29(26,27)23-9-10-4-2-1-3-5-10)6-11-7-13(17(24)25)16(18(20,21)22)28-15(11)14/h1-6,8,13,16,23H,7,9H2,(H,24,25)