2-pyridin-4-ylethyl benzoate hydrochloride

Systemtic Name: 2-pyridin-4-ylethyl benzoate hydrochloride Openeye Name: 2-(4-pyridyl)ethyl benzoate hydrochloride CAS Name: benzoic acid 2-pyridin-4-ylethyl ester hydrochloride IUPAC Name: 2-pyridin-4-ylethyl benzoate hydrochloride Traditional Name: benzoic acid 2-(4-pyridyl)ethyl ester hydrochloride Formula: C14H14ClNO2 MolecularWeight: 263.71946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCC2=CC=NC=C2.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCC2=CC=NC=C2.Cl

InChI

InChI=1S/C14H13NO2.ClH/c16-14(13-4-2-1-3-5-13)17-11-8-12-6-9-15-10-7-12;/h1-7,9-10H,8,11H2;1H