[4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-(3-methylpiperidin-1-yl)methanone

Systemtic Name: [4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-(3-methylpiperidin-1-yl)methanone Openeye Name: [4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-(3-methyl-1-piperidyl)methanone CAS Name: [4-(4-fluorophenyl)sulfonyl-3-nitrophenyl]-(3-methyl-1-piperidinyl)methanone IUPAC Name: [4-(4-fluorophenyl)sulfonyl-3-nitrophenyl]-(3-methylpiperidin-1-yl)methanone Traditional Name: [4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-(3-methylpiperidino)methanone Formula: C19H19FN2O5S MolecularWeight: 406.427963

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19FN2O5S/c1-13-3-2-10-21(12-13)19(23)14-4-9-18(17(11-14)22(24)25)28(26,27)16-7-5-15(20)6-8-16/h4-9,11,13H,2-3,10,12H2,1H3