(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 5-cyclopropyl-2-phenylpyrazole-3-carboxylate Traditional Name: 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H21N3O3/c1-15(21(26)23-17-8-4-2-5-9-17)28-22(27)20-14-19(16-12-13-16)24-25(20)18-10-6-3-7-11-18/h2-11,14-16H,12-13H2,1H3,(H,23,26)