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

Systemtic Name: ethyl 4-[(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]amino]-4-oxo-butanoate CAS Name: 4-[[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]amino]-4-oxobutanoate Traditional Name: 4-[[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]amino]-4-keto-butyric acid ethyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC2=C(CCN(C2)C(=O)C3CC3)C=C1

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC2=C(CCN(C2)C(=O)C3CC3)C=C1

InChI

InChI=1S/C19H24N2O4/c1-2-25-18(23)8-7-17(22)20-16-6-5-13-9-10-21(12-15(13)11-16)19(24)14-3-4-14/h5-6,11,14H,2-4,7-10,12H2,1H3,(H,20,22)