(2-oxidanylidene-2-phenylazanyl-ethyl) 5-propan-2-yl-1-pyridin-2-yl-pyrazole-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 5-propan-2-yl-1-pyridin-2-yl-pyrazole-4-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 5-isopropyl-1-(2-pyridyl)pyrazole-4-carboxylate CAS Name: 5-propan-2-yl-1-(2-pyridinyl)-4-pyrazolecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 5-propan-2-yl-1-pyridin-2-ylpyrazole-4-carboxylate Traditional Name: 5-isopropyl-1-(2-pyridyl)pyrazole-4-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=CC=N2)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=CC=N2)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3/c1-14(2)19-16(12-22-24(19)17-10-6-7-11-21-17)20(26)27-13-18(25)23-15-8-4-3-5-9-15/h3-12,14H,13H2,1-2H3,(H,23,25)