1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-[4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[4-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H20F3N3O5S MolecularWeight: 471.45011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O5S/c1-13-2-7-17(26(28)29)12-18(13)32(30,31)25-10-8-14(9-11-25)19(27)24-16-5-3-15(4-6-16)20(21,22)23/h2-7,12,14H,8-11H2,1H3,(H,24,27)