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

Systemtic Name: [4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-piperidin-1-yl-phenyl)methanone Openeye Name: [4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-[3-nitro-4-(1-piperidyl)phenyl]methanone CAS Name: [4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-[3-nitro-4-(1-piperidinyl)phenyl]methanone IUPAC Name: [4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-piperidin-1-ylphenyl)methanone Traditional Name: [4-(2-fluorophenyl)sulfonylpiperazino]-(3-nitro-4-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)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)[N+](=O)[O-]

InChI

InChI=1S/C22H25FN4O5S/c23-18-6-2-3-7-21(18)33(31,32)26-14-12-25(13-15-26)22(28)17-8-9-19(20(16-17)27(29)30)24-10-4-1-5-11-24/h2-3,6-9,16H,1,4-5,10-15H2