1-(4-fluorophenyl)-5-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]pentane-1,5-dione

Systemtic Name: 1-(4-fluorophenyl)-5-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]pentane-1,5-dione Openeye Name: 1-(4-fluorophenyl)-5-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]pentane-1,5-dione CAS Name: 1-(4-fluorophenyl)-5-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]pentane-1,5-dione IUPAC Name: 1-(4-fluorophenyl)-5-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]pentane-1,5-dione Traditional Name: 1-(4-fluorophenyl)-5-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]pentane-1,5-dione Formula: C22H24FN3O7S MolecularWeight: 493.505263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C22H24FN3O7S/c1-33-21-10-9-18(15-19(21)26(29)30)34(31,32)25-13-11-24(12-14-25)22(28)4-2-3-20(27)16-5-7-17(23)8-6-16/h5-10,15H,2-4,11-14H2,1H3