diethyl 2-[[(6,7-dimethoxyquinazolin-4-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(6,7-dimethoxyquinazolin-4-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(6,7-dimethoxyquinazolin-4-yl)amino]methylene]propanedioate CAS Name: 2-[[(6,7-dimethoxy-4-quinazolinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(6,7-dimethoxyquinazolin-4-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(6,7-dimethoxyquinazolin-4-yl)amino]methylene]malonic acid diethyl ester Formula: C18H21N3O6 MolecularWeight: 375.37584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC=NC2=CC(=C(C=C21)OC)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NC=NC2=CC(=C(C=C21)OC)OC)C(=O)OCC

InChI

InChI=1S/C18H21N3O6/c1-5-26-17(22)12(18(23)27-6-2)9-19-16-11-7-14(24-3)15(25-4)8-13(11)20-10-21-16/h7-10H,5-6H2,1-4H3,(H,19,20,21)