diethyl 2-[[6-(morpholin-4-ylmethyl)-3-oxidanylidene-2,4-dihydroquinoxalin-1-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[6-(morpholin-4-ylmethyl)-3-oxidanylidene-2,4-dihydroquinoxalin-1-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[6-(morpholinomethyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methylene]propanedioate CAS Name: 2-[[6-(4-morpholinylmethyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[6-(morpholin-4-ylmethyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methylidene]propanedioate Traditional Name: 2-[[3-keto-6-(morpholinomethyl)-2,4-dihydroquinoxalin-1-yl]methylene]malonic acid diethyl ester Formula: C21H27N3O6 MolecularWeight: 417.45558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1CC(=O)NC2=C1C=CC(=C2)CN3CCOCC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CN1CC(=O)NC2=C1C=CC(=C2)CN3CCOCC3)C(=O)OCC

InChI

InChI=1S/C21H27N3O6/c1-3-29-20(26)16(21(27)30-4-2)13-24-14-19(25)22-17-11-15(5-6-18(17)24)12-23-7-9-28-10-8-23/h5-6,11,13H,3-4,7-10,12,14H2,1-2H3,(H,22,25)