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

Systemtic Name: methyl 3-[5-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate Openeye Name: methyl 3-[5-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methyl]-2-furyl]benzoate CAS Name: 3-[5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 3-[5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methyl]-2-furyl]benzoic acid methyl ester Formula: C17H12N2O6 MolecularWeight: 340.28698

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C17H12N2O6/c1-24-16(22)10-4-2-3-9(7-10)13-6-5-11(25-13)8-12-14(20)18-17(23)19-15(12)21/h2-8H,1H3,(H2,18,19,20,21,23)