4-methyl-1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperidine

Systemtic Name: 4-methyl-1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperidine Openeye Name: 4-methyl-1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperidine CAS Name: 4-methyl-1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperidine IUPAC Name: 4-methyl-1-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperidine Traditional Name: 4-methyl-1-(2-nitro-4-triflyl-phenyl)piperidine Formula: C13H15F3N2O4S MolecularWeight: 352.32941

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H15F3N2O4S/c1-9-4-6-17(7-5-9)11-3-2-10(8-12(11)18(19)20)23(21,22)13(14,15)16/h2-3,8-9H,4-7H2,1H3