methyl 4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoate

Systemtic Name: methyl 4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoate Openeye Name: methyl 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]benzoate CAS Name: 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoate Traditional Name: 4-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)azo]benzoic acid methyl ester Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C18H16N4O3/c1-12-16(17(23)22(21-12)15-6-4-3-5-7-15)20-19-14-10-8-13(9-11-14)18(24)25-2/h3-11,16H,1-2H3