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

Systemtic Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone Openeye Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone CAS Name: [4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-(4-methyl-3-nitrophenyl)methanone IUPAC Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(4-methyl-3-nitrophenyl)methanone Traditional Name: [4-(3-fluorophenyl)sulfonylpiperazino]-(4-methyl-3-nitro-phenyl)methanone Formula: C18H18FN3O5S MolecularWeight: 407.416023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18FN3O5S/c1-13-5-6-14(11-17(13)22(24)25)18(23)20-7-9-21(10-8-20)28(26,27)16-4-2-3-15(19)12-16/h2-6,11-12H,7-10H2,1H3