(2-oxidanylidene-2-phenylazanyl-ethyl) 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-acetate CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-oxoacetic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetate Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-acetic acid (2-anilino-2-keto-ethyl) ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4/c1-14-19(15(2)24(23-14)17-11-7-4-8-12-17)20(26)21(27)28-13-18(25)22-16-9-5-3-6-10-16/h3-12H,13H2,1-2H3,(H,22,25)