ethyl 2-[2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-1-oxidanylidene-isoquinolin-5-yl]oxypropanoate

Systemtic Name: ethyl 2-[2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-1-oxidanylidene-isoquinolin-5-yl]oxypropanoate Openeye Name: ethyl 2-[[2-(2-tert-butoxy-2-oxo-ethyl)-1-oxo-5-isoquinolyl]oxy]propanoate CAS Name: 2-[[2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1-oxo-5-isoquinolinyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxypropanoate Traditional Name: 2-[[2-(2-tert-butoxy-2-keto-ethyl)-1-keto-5-isoquinolyl]oxy]propionic acid ethyl ester Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C20H25NO6/c1-6-25-19(24)13(2)26-16-9-7-8-15-14(16)10-11-21(18(15)23)12-17(22)27-20(3,4)5/h7-11,13H,6,12H2,1-5H3