ethyl 1-(4-tert-butylphenyl)-5-oxidanylidene-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-tert-butylphenyl)-5-oxidanylidene-4H-pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-tert-butylphenyl)-5-oxo-4H-pyrazole-3-carboxylate CAS Name: 1-(4-tert-butylphenyl)-5-oxo-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-tert-butylphenyl)-5-oxo-4H-pyrazole-3-carboxylate Traditional Name: 1-(4-tert-butylphenyl)-5-keto-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C16H20N2O3/c1-5-21-15(20)13-10-14(19)18(17-13)12-8-6-11(7-9-12)16(2,3)4/h6-9H,5,10H2,1-4H3