1-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Openeye Name: 1-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one CAS Name: 1-[4-[(4-fluorophenyl)methyl]-1-piperazinyl]-2-methyl-3-(4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[4-(4-fluorobenzyl)piperazino]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Formula: C18H22FN5O3 MolecularWeight: 375.397383

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN5O3/c1-14(11-23-13-17(10-20-23)24(26)27)18(25)22-8-6-21(7-9-22)12-15-2-4-16(19)5-3-15/h2-5,10,13-14H,6-9,11-12H2,1H3