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

Systemtic Name: 4-azanyl-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-nitro-benzamide CAS Name: 4-amino-N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-3-nitrobenzamide Traditional Name: 4-amino-N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-nitro-benzamide Formula: C23H18FN5O3 MolecularWeight: 431.419123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)C4=CC(=C(C=C4)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)C4=CC(=C(C=C4)N)[N+](=O)[O-]

InChI

InChI=1S/C23H18FN5O3/c24-18-9-6-15(7-10-18)22-17(14-28(27-22)19-4-2-1-3-5-19)13-26-23(30)16-8-11-20(25)21(12-16)29(31)32/h1-12,14H,13,25H2,(H,26,30)