[(S)-isoquinolin-1-yl(phenyl)methyl] propanoate

Systemtic Name: [(S)-isoquinolin-1-yl(phenyl)methyl] propanoate Openeye Name: [(S)-1-isoquinolyl(phenyl)methyl] propanoate CAS Name: propanoic acid [(S)-1-isoquinolinyl(phenyl)methyl] ester IUPAC Name: [(S)-isoquinolin-1-yl(phenyl)methyl] propanoate Traditional Name: propionic acid [(S)-1-isoquinolyl(phenyl)methyl] ester Formula: C19H17NO2 MolecularWeight: 291.34378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C1=CC=CC=C1)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

CCC(=O)O[C@@H](C1=CC=CC=C1)C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C19H17NO2/c1-2-17(21)22-19(15-9-4-3-5-10-15)18-16-11-7-6-8-14(16)12-13-20-18/h3-13,19H,2H2,1H3/t19-/m0/s1