N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-methyl-2-nitro-benzamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-methyl-2-nitro-benzamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-methyl-2-nitro-benzamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-3-methyl-2-nitrobenzamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-methyl-2-nitro-benzamide Formula: C24H19FN4O3 MolecularWeight: 430.431063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C24H19FN4O3/c1-16-6-5-9-21(23(16)29(31)32)24(30)26-14-18-15-28(20-7-3-2-4-8-20)27-22(18)17-10-12-19(25)13-11-17/h2-13,15H,14H2,1H3,(H,26,30)