2-[4-[(Z)-[1-(3-chloranyl-4-methoxy-phenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-[1-(3-chloranyl-4-methoxy-phenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-[1-(3-chloro-4-methoxy-phenyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-[1-(3-chloro-4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(Z)-[1-(3-chloro-4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-[1-(3-chloro-4-methoxy-phenyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate Formula: C21H16ClN2O8- MolecularWeight: 459.81334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)[O-])OC)C(=O)NC2=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)/C(=C\C3=CC(=C(C=C3)OCC(=O)[O-])OC)/C(=O)NC2=O)Cl

InChI

InChI=1S/C21H17ClN2O8/c1-30-15-6-4-12(9-14(15)22)24-20(28)13(19(27)23-21(24)29)7-11-3-5-16(17(8-11)31-2)32-10-18(25)26/h3-9H,10H2,1-2H3,(H,25,26)(H,23,27,29)/p-1/b13-7-