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

Systemtic Name: ethyl 4-(5-oxidanylidene-3-pyridin-3-yl-4H-pyrazol-1-yl)benzoate Openeye Name: ethyl 4-[5-oxo-3-(3-pyridyl)-4H-pyrazol-1-yl]benzoate CAS Name: 4-[5-oxo-3-(3-pyridinyl)-4H-pyrazol-1-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-oxo-3-pyridin-3-yl-4H-pyrazol-1-yl)benzoate Traditional Name: 4-[5-keto-3-(3-pyridyl)-2-pyrazolin-1-yl]benzoic acid ethyl ester Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(=N2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C17H15N3O3/c1-2-23-17(22)12-5-7-14(8-6-12)20-16(21)10-15(19-20)13-4-3-9-18-11-13/h3-9,11H,2,10H2,1H3