methyl 2-[[2-(2-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]propanoate

Systemtic Name: methyl 2-[[2-(2-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]propanoate Openeye Name: methyl 2-[[2-(2-methoxyphenyl)-1-oxo-isoquinoline-4-carbonyl]amino]propanoate CAS Name: 2-[[[2-(2-methoxyphenyl)-1-oxo-4-isoquinolinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-methoxyphenyl)-1-oxoisoquinoline-4-carbonyl]amino]propanoate Traditional Name: 2-[[1-keto-2-(2-methoxyphenyl)isoquinoline-4-carbonyl]amino]propionic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3OC

Isomeric SMILES

CC(C(=O)OC)NC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3OC

InChI

InChI=1S/C21H20N2O5/c1-13(21(26)28-3)22-19(24)16-12-23(17-10-6-7-11-18(17)27-2)20(25)15-9-5-4-8-14(15)16/h4-13H,1-3H3,(H,22,24)