(2-azanyl-2-oxidanylidene-ethyl) 1-(4-methylphenyl)-3-phenyl-pyrazole-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 1-(4-methylphenyl)-3-phenyl-pyrazole-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 3-phenyl-1-(p-tolyl)pyrazole-4-carboxylate CAS Name: 1-(4-methylphenyl)-3-phenyl-4-pyrazolecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-(4-methylphenyl)-3-phenylpyrazole-4-carboxylate Traditional Name: 3-phenyl-1-(p-tolyl)pyrazole-4-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3)C(=O)OCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3)C(=O)OCC(=O)N

InChI

InChI=1S/C19H17N3O3/c1-13-7-9-15(10-8-13)22-11-16(19(24)25-12-17(20)23)18(21-22)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H2,20,23)