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isoquinolin-1-ylmethyl benzoate hydrochloride

isoquinolin-1-ylmethyl benzoate hydrochloride

Systemtic Name:isoquinolin-1-ylmethyl benzoate hydrochloride
Openeye Name:1-isoquinolylmethyl benzoate hydrochloride
CAS Name:benzoic acid 1-isoquinolinylmethyl ester hydrochloride
IUPAC Name:isoquinolin-1-ylmethyl benzoate hydrochloride
Traditional Name:benzoic acid 1-isoquinolylmethyl ester hydrochloride
Formula: C17H14ClNO2
MolecularWeight: 299.75156
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2=NC=CC3=CC=CC=C32.Cl


Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC2=NC=CC3=CC=CC=C32.Cl


InChI

InChI=1S/C17H13NO2.ClH/c19-17(14-7-2-1-3-8-14)20-12-16-15-9-5-4-6-13(15)10-11-18-16;/h1-11H,12H2;1H


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