diethyl 2-[[(4-oxidanylidenequinazolin-3-yl)methylamino]methyl]propanedioate dihydrochloride

Systemtic Name: diethyl 2-[[(4-oxidanylidenequinazolin-3-yl)methylamino]methyl]propanedioate dihydrochloride Openeye Name: diethyl 2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]propanedioate dihydrochloride CAS Name: 2-[[(4-oxo-3-quinazolinyl)methylamino]methyl]propanedioic acid diethyl ester dihydrochloride IUPAC Name: diethyl 2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]propanedioate dihydrochloride Traditional Name: 2-[[(4-ketoquinazolin-3-yl)methylamino]methyl]malonic acid diethyl ester dihydrochloride Formula: C17H23Cl2N3O5 MolecularWeight: 420.28762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNCN1C=NC2=CC=CC=C2C1=O)C(=O)OCC.Cl.Cl

Isomeric SMILES

CCOC(=O)C(CNCN1C=NC2=CC=CC=C2C1=O)C(=O)OCC.Cl.Cl

InChI

InChI=1S/C17H21N3O5.2ClH/c1-3-24-16(22)13(17(23)25-4-2)9-18-10-20-11-19-14-8-6-5-7-12(14)15(20)21;;/h5-8,11,13,18H,3-4,9-10H2,1-2H3;2*1H