ethyl 3-(4-oxidanylidene-2,3-dihydro-1H-isoquinolin-3-yl)propanoate

Systemtic Name: ethyl 3-(4-oxidanylidene-2,3-dihydro-1H-isoquinolin-3-yl)propanoate Openeye Name: ethyl 3-(4-oxo-2,3-dihydro-1H-isoquinolin-3-yl)propanoate CAS Name: 3-(4-oxo-2,3-dihydro-1H-isoquinolin-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-oxo-2,3-dihydro-1H-isoquinolin-3-yl)propanoate Traditional Name: 3-(4-keto-2,3-dihydro-1H-isoquinolin-3-yl)propionic acid ethyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1C(=O)C2=CC=CC=C2CN1

Isomeric SMILES

CCOC(=O)CCC1C(=O)C2=CC=CC=C2CN1

InChI

InChI=1S/C14H17NO3/c1-2-18-13(16)8-7-12-14(17)11-6-4-3-5-10(11)9-15-12/h3-6,12,15H,2,7-9H2,1H3