ethyl 2-(2-morpholin-4-ium-4-ylethylamino)-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(2-morpholin-4-ium-4-ylethylamino)-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(2-morpholin-4-ium-4-ylethylamino)-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-[2-(4-morpholin-4-iumyl)ethylamino]-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-morpholin-4-ium-4-ylethylamino)-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 6-keto-2-(2-morpholin-4-ium-4-ylethylamino)-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H21N4O4+ MolecularWeight: 297.33024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)NCC[NH+]2CCOCC2

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)NCC[NH+]2CCOCC2

InChI

InChI=1S/C13H20N4O4/c1-2-21-12(19)10-9-15-13(16-11(10)18)14-3-4-17-5-7-20-8-6-17/h9H,2-8H2,1H3,(H2,14,15,16,18)/p+1