(6-chloranylpyridin-3-yl)methyl 4-(2-acetamidoethyl)benzoate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 4-(2-acetamidoethyl)benzoate Openeye Name: (6-chloro-3-pyridyl)methyl 4-(2-acetamidoethyl)benzoate CAS Name: 4-(2-acetamidoethyl)benzoic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 4-(2-acetamidoethyl)benzoate Traditional Name: 4-(2-acetamidoethyl)benzoic acid (6-chloro-3-pyridyl)methyl ester Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C(=O)OCC2=CN=C(C=C2)Cl

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C(=O)OCC2=CN=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O3/c1-12(21)19-9-8-13-2-5-15(6-3-13)17(22)23-11-14-4-7-16(18)20-10-14/h2-7,10H,8-9,11H2,1H3,(H,19,21)