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

Systemtic Name: tert-butyl 1-(4-tert-butylphenyl)-5-oxidanylidene-4H-pyrazole-3-carboxylate Openeye Name: tert-butyl 1-(4-tert-butylphenyl)-5-oxo-4H-pyrazole-3-carboxylate CAS Name: 1-(4-tert-butylphenyl)-5-oxo-4H-pyrazole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(4-tert-butylphenyl)-5-oxo-4H-pyrazole-3-carboxylate Traditional Name: 1-(4-tert-butylphenyl)-5-keto-2-pyrazoline-3-carboxylic acid tert-butyl ester Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=O)CC(=N2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=O)CC(=N2)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H24N2O3/c1-17(2,3)12-7-9-13(10-8-12)20-15(21)11-14(19-20)16(22)23-18(4,5)6/h7-10H,11H2,1-6H3