4-[(3,5-diphenyl-1-pyridin-4-ylcarbonyl-pyrazol-4-yl)diazenyl]benzoic acid

Systemtic Name: 4-[(3,5-diphenyl-1-pyridin-4-ylcarbonyl-pyrazol-4-yl)diazenyl]benzoic acid Openeye Name: 4-[3,5-diphenyl-1-(pyridine-4-carbonyl)pyrazol-4-yl]azobenzoic acid CAS Name: 4-[[1-[oxo(pyridin-4-yl)methyl]-3,5-diphenyl-4-pyrazolyl]azo]benzoic acid IUPAC Name: 4-[[3,5-diphenyl-1-(pyridine-4-carbonyl)pyrazol-4-yl]diazenyl]benzoic acid Traditional Name: 4-(1-isonicotinoyl-3,5-diphenyl-pyrazol-4-yl)azobenzoic acid Formula: C28H19N5O3 MolecularWeight: 473.48216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C(=O)C3=CC=NC=C3)C4=CC=CC=C4)N=NC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C(=O)C3=CC=NC=C3)C4=CC=CC=C4)N=NC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C28H19N5O3/c34-27(21-15-17-29-18-16-21)33-26(20-9-5-2-6-10-20)25(24(32-33)19-7-3-1-4-8-19)31-30-23-13-11-22(12-14-23)28(35)36/h1-18H,(H,35,36)