methyl 4-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methyl]benzoate CAS Name: 4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoate Traditional Name: 4-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methyl]benzoic acid methyl ester Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)NC(=O)NC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C13H10N2O5/c1-20-12(18)8-4-2-7(3-5-8)6-9-10(16)14-13(19)15-11(9)17/h2-6H,1H3,(H2,14,15,16,17,19)