2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-(trifluoromethyl)benzenesulfonamide; ethanedioic acid

Systemtic Name: 2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-(trifluoromethyl)benzenesulfonamide; ethanedioic acid Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(trifluoromethyl)benzenesulfonamide; oxalic acid CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(trifluoromethyl)benzenesulfonamide; oxalic acid IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(trifluoromethyl)benzenesulfonamide; oxalic acid Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(trifluoromethyl)benzenesulfonamide; oxalic acid Formula: C18H13ClF3NO9S MolecularWeight: 511.81033

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)OCO2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)OCO2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H11ClF3NO5S.C2H2O4/c1-8(22)10-5-13-14(26-7-25-13)6-12(10)21-27(23,24)15-4-9(16(18,19)20)2-3-11(15)17;3-1(4)2(5)6/h2-6,21H,7H2,1H3;(H,3,4)(H,5,6)