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

Systemtic Name: N-cyclopropyl-2-methoxy-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Openeye Name: N-cyclopropyl-2-methoxy-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide CAS Name: N-cyclopropyl-2-methoxy-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-2-methoxy-5-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Traditional Name: N-cyclopropyl-2-methoxy-5-nitro-N-[4-(trifluoromethyl)benzyl]benzenesulfonamide Formula: C18H17F3N2O5S MolecularWeight: 430.39819

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)C(F)(F)F)C3CC3

Isomeric SMILES

COC1=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/C18H17F3N2O5S/c1-28-16-9-8-15(23(24)25)10-17(16)29(26,27)22(14-6-7-14)11-12-2-4-13(5-3-12)18(19,20)21/h2-5,8-10,14H,6-7,11H2,1H3