1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butan-1-one

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butan-1-one Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butan-1-one CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-4-(5-methyl-3-nitro-1-pyrazolyl)-1-butanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-4-(5-methyl-3-nitropyrazol-1-yl)butan-1-one Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-4-(5-methyl-3-nitro-pyrazol-1-yl)butan-1-one Formula: C18H22FN5O3 MolecularWeight: 375.397383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H22FN5O3/c1-14-13-17(24(26)27)20-23(14)8-2-3-18(25)22-11-9-21(10-12-22)16-6-4-15(19)5-7-16/h4-7,13H,2-3,8-12H2,1H3