ethanoic acid; pyridin-2-ylmethyl 2-oxidanyl-2,2-diphenyl-ethanoate; hydrochloride

Systemtic Name: ethanoic acid; pyridin-2-ylmethyl 2-oxidanyl-2,2-diphenyl-ethanoate; hydrochloride Openeye Name: acetic acid; 2-pyridylmethyl 2-hydroxy-2,2-diphenyl-acetate; hydrochloride CAS Name: acetic acid; 2-hydroxy-2,2-diphenylacetic acid 2-pyridinylmethyl ester; hydrochloride IUPAC Name: acetic acid; pyridin-2-ylmethyl 2-hydroxy-2,2-diphenylacetate; hydrochloride Traditional Name: acetic acid; 2-hydroxy-2,2-diphenyl-acetic acid 2-pyridylmethyl ester; hydrochloride Formula: C22H22ClNO5 MolecularWeight: 415.86678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCC3=CC=CC=N3)O.Cl

Isomeric SMILES

CC(=O)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCC3=CC=CC=N3)O.Cl

InChI

InChI=1S/C20H17NO3.C2H4O2.ClH/c22-19(24-15-18-13-7-8-14-21-18)20(23,16-9-3-1-4-10-16)17-11-5-2-6-12-17;1-2(3)4;/h1-14,23H,15H2;1H3,(H,3,4);1H