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

Systemtic Name: 4-[[4-[(E)-[1-(3-chlorophenyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoate Openeye Name: 4-[[4-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoate IUPAC Name: 4-[[4-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-[1-(3-chlorophenyl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]methyl]benzoate Formula: C25H16ClN2O6- MolecularWeight: 475.85734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N2C(=O)C(=CC3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)[O-])C(=O)NC2=O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N2C(=O)/C(=C/C3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)[O-])/C(=O)NC2=O

InChI

InChI=1S/C25H17ClN2O6/c26-18-2-1-3-19(13-18)28-23(30)21(22(29)27-25(28)33)12-15-6-10-20(11-7-15)34-14-16-4-8-17(9-5-16)24(31)32/h1-13H,14H2,(H,31,32)(H,27,29,33)/p-1/b21-12+