(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 5-cyclopropyl-2-phenylpyrazole-3-carboxylate Traditional Name: 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O3/c22-20(25)19(15-7-3-1-4-8-15)27-21(26)18-13-17(14-11-12-14)23-24(18)16-9-5-2-6-10-16/h1-10,13-14,19H,11-12H2,(H2,22,25)