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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C(=C1)N2C=CC=N2)C3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CN1C=C(C(=O)C(=C1)N2C=CC=N2)C3=CC(=CC=C3)C(=O)OC

InChI

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