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

Systemtic Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone Openeye Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone CAS Name: [4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-[4-(methylamino)-3-nitrophenyl]methanone IUPAC Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitrophenyl]methanone Traditional Name: [4-(3-fluorophenyl)sulfonylpiperazino]-[4-(methylamino)-3-nitro-phenyl]methanone Formula: C18H19FN4O5S MolecularWeight: 422.430663

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H19FN4O5S/c1-20-16-6-5-13(11-17(16)23(25)26)18(24)21-7-9-22(10-8-21)29(27,28)15-4-2-3-14(19)12-15/h2-6,11-12,20H,7-10H2,1H3