(3-fluoranyl-4-methyl-5-nitro-phenyl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-fluoranyl-4-methyl-5-nitro-phenyl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-fluoro-4-methyl-5-nitro-phenyl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3-fluoro-4-methyl-5-nitrophenyl)-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-fluoro-4-methyl-5-nitrophenyl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-fluoro-4-methyl-5-nitro-phenyl)-[4-(3-fluorophenyl)sulfonylpiperazino]methanone Formula: C18H17F2N3O5S MolecularWeight: 425.406486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17F2N3O5S/c1-12-16(20)9-13(10-17(12)23(25)26)18(24)21-5-7-22(8-6-21)29(27,28)15-4-2-3-14(19)11-15/h2-4,9-11H,5-8H2,1H3