[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(5-nitro-2-piperidin-1-yl-phenyl)methanone

Systemtic Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(5-nitro-2-piperidin-1-yl-phenyl)methanone Openeye Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[5-nitro-2-(1-piperidyl)phenyl]methanone CAS Name: [4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-[5-nitro-2-(1-piperidinyl)phenyl]methanone IUPAC Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(5-nitro-2-piperidin-1-ylphenyl)methanone Traditional Name: [4-(3-fluorophenyl)sulfonylpiperazino]-(5-nitro-2-piperidino-phenyl)methanone Formula: C22H25FN4O5S MolecularWeight: 476.521103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C22H25FN4O5S/c23-17-5-4-6-19(15-17)33(31,32)26-13-11-25(12-14-26)22(28)20-16-18(27(29)30)7-8-21(20)24-9-2-1-3-10-24/h4-8,15-16H,1-3,9-14H2