6-(furan-2-ylmethylsulfamoyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-(furan-2-ylmethylsulfamoyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-(2-furylmethylsulfamoyl)-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-(2-furanylmethylsulfamoyl)-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-(furan-2-ylmethylsulfamoyl)-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-(2-furfurylsulfamoyl)-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C16H14F3NO6S MolecularWeight: 405.34567

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C1C=C(C=C2)S(=O)(=O)NCC3=CC=CO3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C1C=C(C=C2)S(=O)(=O)NCC3=CC=CO3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H14F3NO6S/c17-16(18,19)14-12(15(21)22)7-9-6-11(3-4-13(9)26-14)27(23,24)20-8-10-2-1-5-25-10/h1-6,12,14,20H,7-8H2,(H,21,22)