methyl 4-propanoyl-3-pyridin-2-yl-benzoate

Systemtic Name: methyl 4-propanoyl-3-pyridin-2-yl-benzoate Openeye Name: methyl 4-propanoyl-3-(2-pyridyl)benzoate CAS Name: 4-(1-oxopropyl)-3-(2-pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 4-propanoyl-3-pyridin-2-ylbenzoate Traditional Name: 4-propionyl-3-(2-pyridyl)benzoic acid methyl ester Formula: C16H15NO3 MolecularWeight: 269.2952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=C(C=C1)C(=O)OC)C2=CC=CC=N2

Isomeric SMILES

CCC(=O)C1=C(C=C(C=C1)C(=O)OC)C2=CC=CC=N2

InChI

InChI=1S/C16H15NO3/c1-3-15(18)12-8-7-11(16(19)20-2)10-13(12)14-6-4-5-9-17-14/h4-10H,3H2,1-2H3