methyl 3-(1-ethyl-6,7-dimethoxy-3-oxidanylidene-2H-isoquinolin-4-yl)propanoate

Systemtic Name: methyl 3-(1-ethyl-6,7-dimethoxy-3-oxidanylidene-2H-isoquinolin-4-yl)propanoate Openeye Name: methyl 3-(1-ethyl-6,7-dimethoxy-3-oxo-2H-isoquinolin-4-yl)propanoate CAS Name: 3-(1-ethyl-6,7-dimethoxy-3-oxo-2H-isoquinolin-4-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(1-ethyl-6,7-dimethoxy-3-oxo-2H-isoquinolin-4-yl)propanoate Traditional Name: 3-(1-ethyl-3-keto-6,7-dimethoxy-2H-isoquinolin-4-yl)propionic acid methyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C(C(=CC2=C(C(=O)N1)CCC(=O)OC)OC)OC

Isomeric SMILES

CCC1=C2C=C(C(=CC2=C(C(=O)N1)CCC(=O)OC)OC)OC

InChI

InChI=1S/C17H21NO5/c1-5-13-12-9-15(22-3)14(21-2)8-11(12)10(17(20)18-13)6-7-16(19)23-4/h8-9H,5-7H2,1-4H3,(H,18,20)