methyl 2-(3-methoxyisoquinolin-7-yl)ethanoate

Systemtic Name: methyl 2-(3-methoxyisoquinolin-7-yl)ethanoate Openeye Name: methyl 2-(3-methoxy-7-isoquinolyl)acetate CAS Name: 2-(3-methoxy-7-isoquinolinyl)acetic acid methyl ester IUPAC Name: methyl 2-(3-methoxyisoquinolin-7-yl)acetate Traditional Name: 2-(3-methoxy-7-isoquinolyl)acetic acid methyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C2C=C(C=CC2=C1)CC(=O)OC

Isomeric SMILES

COC1=NC=C2C=C(C=CC2=C1)CC(=O)OC

InChI

InChI=1S/C13H13NO3/c1-16-12-7-10-4-3-9(6-13(15)17-2)5-11(10)8-14-12/h3-5,7-8H,6H2,1-2H3