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

Systemtic Name: ethyl 4-(5-oxidanylidene-3-propyl-4H-pyrazol-1-yl)benzoate Openeye Name: ethyl 4-(5-oxo-3-propyl-4H-pyrazol-1-yl)benzoate CAS Name: 4-(5-oxo-3-propyl-4H-pyrazol-1-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-oxo-3-propyl-4H-pyrazol-1-yl)benzoate Traditional Name: 4-(5-keto-3-propyl-2-pyrazolin-1-yl)benzoic acid ethyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1)C2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCC1=NN(C(=O)C1)C2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C15H18N2O3/c1-3-5-12-10-14(18)17(16-12)13-8-6-11(7-9-13)15(19)20-4-2/h6-9H,3-5,10H2,1-2H3