ethyl (2R)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanoate

Systemtic Name: ethyl (2R)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanoate Openeye Name: ethyl (2R)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanoate CAS Name: (2R)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanoate Traditional Name: (2R)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propionic acid ethyl ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=NC(CC2=CC=CC=C21)(C)C

Isomeric SMILES

CCOC(=O)[C@H](C)C1=NC(CC2=CC=CC=C21)(C)C

InChI

InChI=1S/C16H21NO2/c1-5-19-15(18)11(2)14-13-9-7-6-8-12(13)10-16(3,4)17-14/h6-9,11H,5,10H2,1-4H3/t11-/m1/s1