N-cyclopropyl-2-methyl-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: N-cyclopropyl-2-methyl-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Openeye Name: N-cyclopropyl-2-methyl-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide CAS Name: N-cyclopropyl-2-methyl-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-2-methyl-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Traditional Name: N-cyclopropyl-2-methyl-5-nitro-N-[4-(trifluoromethyl)benzyl]benzenesulfonamide Formula: C18H17F3N2O4S MolecularWeight: 414.39879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)C(F)(F)F)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)C(F)(F)F)C3CC3

InChI

InChI=1S/C18H17F3N2O4S/c1-12-2-7-16(23(24)25)10-17(12)28(26,27)22(15-8-9-15)11-13-3-5-14(6-4-13)18(19,20)21/h2-7,10,15H,8-9,11H2,1H3