ethyl 4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzoate

Systemtic Name: ethyl 4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzoate Openeye Name: ethyl 4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoate CAS Name: 4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoate Traditional Name: 4-(5-keto-3-methyl-2-pyrazolin-1-yl)benzoic acid ethyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3/c1-3-18-13(17)10-4-6-11(7-5-10)15-12(16)8-9(2)14-15/h4-7H,3,8H2,1-2H3