3-[[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]benzoic acid Openeye Name: 3-[[3-(4-nitrophenyl)-1-phenyl-pyrazole-4-carbonyl]amino]benzoic acid CAS Name: 3-[[[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[3-(4-nitrophenyl)-1-phenylpyrazole-4-carbonyl]amino]benzoic acid Traditional Name: 3-[[3-(4-nitrophenyl)-1-phenyl-pyrazole-4-carbonyl]amino]benzoic acid Formula: C23H16N4O5 MolecularWeight: 428.39694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H16N4O5/c28-22(24-17-6-4-5-16(13-17)23(29)30)20-14-26(18-7-2-1-3-8-18)25-21(20)15-9-11-19(12-10-15)27(31)32/h1-14H,(H,24,28)(H,29,30)