ethyl 4-[(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-oxo-butanoate CAS Name: 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-oxobutanoate Traditional Name: 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-keto-butyric acid ethyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC2=C(CCN(C2)C(=O)C)C=C1

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC2=C(CCN(C2)C(=O)C)C=C1

InChI

InChI=1S/C17H22N2O4/c1-3-23-17(22)7-6-16(21)18-15-5-4-13-8-9-19(12(2)20)11-14(13)10-15/h4-5,10H,3,6-9,11H2,1-2H3,(H,18,21)