ethanoic acid; pyridin-2-ylmethyl 2-oxidanyl-2-phenyl-ethanoate; hydrochloride

Systemtic Name: ethanoic acid; pyridin-2-ylmethyl 2-oxidanyl-2-phenyl-ethanoate; hydrochloride Openeye Name: acetic acid; 2-pyridylmethyl 2-hydroxy-2-phenyl-acetate; hydrochloride CAS Name: acetic acid; 2-hydroxy-2-phenylacetic acid 2-pyridinylmethyl ester; hydrochloride IUPAC Name: acetic acid; pyridin-2-ylmethyl 2-hydroxy-2-phenylacetate; hydrochloride Traditional Name: acetic acid; 2-hydroxy-2-phenyl-acetic acid 2-pyridylmethyl ester; hydrochloride Formula: C16H18ClNO5 MolecularWeight: 339.77082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C(C=C1)C(C(=O)OCC2=CC=CC=N2)O.Cl

Isomeric SMILES

CC(=O)O.C1=CC=C(C=C1)C(C(=O)OCC2=CC=CC=N2)O.Cl

InChI

InChI=1S/C14H13NO3.C2H4O2.ClH/c16-13(11-6-2-1-3-7-11)14(17)18-10-12-8-4-5-9-15-12;1-2(3)4;/h1-9,13,16H,10H2;1H3,(H,3,4);1H