ethyl 4-[2,4,6-tris(oxidanylidene)-1,3-diazinan-1-yl]benzoate

Systemtic Name: ethyl 4-[2,4,6-tris(oxidanylidene)-1,3-diazinan-1-yl]benzoate Openeye Name: ethyl 4-(2,4,6-trioxohexahydropyrimidin-1-yl)benzoate CAS Name: 4-(2,4,6-trioxo-1,3-diazinan-1-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2,4,6-trioxo-1,3-diazinan-1-yl)benzoate Traditional Name: 4-(2,4,6-triketohexahydropyrimidin-1-yl)benzoic acid ethyl ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(=O)NC2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(=O)NC2=O

InChI

InChI=1S/C13H12N2O5/c1-2-20-12(18)8-3-5-9(6-4-8)15-11(17)7-10(16)14-13(15)19/h3-6H,2,7H2,1H3,(H,14,16,19)