diethyl 2-[[(4-methoxyisoquinolin-1-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(4-methoxyisoquinolin-1-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(4-methoxy-1-isoquinolyl)amino]methylene]propanedioate CAS Name: 2-[[(4-methoxy-1-isoquinolinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4-methoxyisoquinolin-1-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(4-methoxy-1-isoquinolyl)amino]methylene]malonic acid diethyl ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC=C(C2=CC=CC=C21)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NC=C(C2=CC=CC=C21)OC)C(=O)OCC

InChI

InChI=1S/C18H20N2O5/c1-4-24-17(21)14(18(22)25-5-2)10-19-16-13-9-7-6-8-12(13)15(23-3)11-20-16/h6-11H,4-5H2,1-3H3,(H,19,20)