2-isoquinolin-1-ylpropan-2-yl benzoate

Systemtic Name: 2-isoquinolin-1-ylpropan-2-yl benzoate Openeye Name: [1-(1-isoquinolyl)-1-methyl-ethyl] benzoate CAS Name: benzoic acid 2-(1-isoquinolinyl)propan-2-yl ester IUPAC Name: 2-isoquinolin-1-ylpropan-2-yl benzoate Traditional Name: benzoic acid [1-(1-isoquinolyl)-1-methyl-ethyl] ester Formula: C19H17NO2 MolecularWeight: 291.34378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC=CC2=CC=CC=C21)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C1=NC=CC2=CC=CC=C21)OC(=O)C3=CC=CC=C3

InChI

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