4-[[2-[[1-(furan-2-ylmethyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-[[1-(furan-2-ylmethyl)-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[[1-(2-furylmethyl)-2,4,6-trioxo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[2-[[1-(2-furanylmethyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-[[1-(furan-2-ylmethyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[[1-(2-furfuryl)-2,4,6-triketo-hexahydropyrimidin-5-ylidene]methyl]phenoxy]methyl]benzoic acid Formula: C24H18N2O7 MolecularWeight: 446.40892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)OCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)OCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H18N2O7/c27-21-19(22(28)26(24(31)25-21)13-18-5-3-11-32-18)12-17-4-1-2-6-20(17)33-14-15-7-9-16(10-8-15)23(29)30/h1-12H,13-14H2,(H,29,30)(H,25,27,31)