diethyl 2-[[(9-oxidanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(9-oxidanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(9-hydroxy-4-oxo-pyrido[1,2-a]pyrimidin-3-yl)amino]methylene]propanedioate CAS Name: 2-[[(9-hydroxy-4-oxo-3-pyrido[1,2-a]pyrimidinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(9-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(9-hydroxy-4-keto-pyrido[1,2-a]pyrimidin-3-yl)amino]methylene]malonic acid diethyl ester Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CN=C2C(=CC=CN2C1=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CN=C2C(=CC=CN2C1=O)O)C(=O)OCC

InChI

InChI=1S/C16H17N3O6/c1-3-24-15(22)10(16(23)25-4-2)8-17-11-9-18-13-12(20)6-5-7-19(13)14(11)21/h5-9,17,20H,3-4H2,1-2H3