1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-3-(trifluoromethyl)piperidine

Systemtic Name: 1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-3-(trifluoromethyl)piperidine Openeye Name: 1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-3-(trifluoromethyl)piperidine CAS Name: 1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-3-(trifluoromethyl)piperidine IUPAC Name: 1-(2-nitro-4-piperidin-1-ylsulfonylphenyl)-3-(trifluoromethyl)piperidine Traditional Name: 1-(2-nitro-4-piperidinosulfonyl-phenyl)-3-(trifluoromethyl)piperidine Formula: C17H22F3N3O4S MolecularWeight: 421.43449

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC(C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC(C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H22F3N3O4S/c18-17(19,20)13-5-4-8-21(12-13)15-7-6-14(11-16(15)23(24)25)28(26,27)22-9-2-1-3-10-22/h6-7,11,13H,1-5,8-10,12H2