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

Systemtic Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone Openeye Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone CAS Name: [4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-(3-methyl-2-nitrophenyl)methanone IUPAC Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(3-methyl-2-nitrophenyl)methanone Traditional Name: [4-(4-fluorophenyl)sulfonylpiperazino]-(3-methyl-2-nitro-phenyl)methanone Formula: C18H18FN3O5S MolecularWeight: 407.416023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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