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

Systemtic Name: ethyl 2-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-3-oxo-butanoate CAS Name: 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-3-oxobutanoate Traditional Name: 2-(2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl)-3-keto-butyric acid ethyl ester Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1C2=CC=CC=C2CCN1C(=O)C)C(=O)C

Isomeric SMILES

CCOC(=O)C(C1C2=CC=CC=C2CCN1C(=O)C)C(=O)C

InChI

InChI=1S/C17H21NO4/c1-4-22-17(21)15(11(2)19)16-14-8-6-5-7-13(14)9-10-18(16)12(3)20/h5-8,15-16H,4,9-10H2,1-3H3