ethyl 3-(isoquinolin-1-ylmethyl)benzoate

Systemtic Name: ethyl 3-(isoquinolin-1-ylmethyl)benzoate Openeye Name: ethyl 3-(1-isoquinolylmethyl)benzoate CAS Name: 3-(1-isoquinolinylmethyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(isoquinolin-1-ylmethyl)benzoate Traditional Name: 3-(1-isoquinolylmethyl)benzoic acid ethyl ester Formula: C19H17NO2 MolecularWeight: 291.34378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)CC2=NC=CC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)CC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C19H17NO2/c1-2-22-19(21)16-8-5-6-14(12-16)13-18-17-9-4-3-7-15(17)10-11-20-18/h3-12H,2,13H2,1H3