isoquinolin-3-ylmethyl ethanoate

Systemtic Name: isoquinolin-3-ylmethyl ethanoate Openeye Name: 3-isoquinolylmethyl acetate CAS Name: acetic acid 3-isoquinolinylmethyl ester IUPAC Name: isoquinolin-3-ylmethyl acetate Traditional Name: acetic acid 3-isoquinolylmethyl ester Formula: C12H11NO2 MolecularWeight: 201.22124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC2=CC=CC=C2C=N1

Isomeric SMILES

CC(=O)OCC1=CC2=CC=CC=C2C=N1

InChI

InChI=1S/C12H11NO2/c1-9(14)15-8-12-6-10-4-2-3-5-11(10)7-13-12/h2-7H,8H2,1H3