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

Systemtic Name: (3-fluorophenyl)-[4-(2-methyl-4-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (3-fluorophenyl)-[4-(2-methyl-4-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (3-fluorophenyl)-[4-(2-methyl-4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (3-fluorophenyl)-[4-(2-methyl-4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (3-fluorophenyl)-[4-(2-methyl-4-nitro-phenyl)piperazino]methanone Formula: C18H18FN3O3 MolecularWeight: 343.352223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18FN3O3/c1-13-11-16(22(24)25)5-6-17(13)20-7-9-21(10-8-20)18(23)14-3-2-4-15(19)12-14/h2-6,11-12H,7-10H2,1H3