[2-ethoxy-4-[(Z)-[2,4,6-tris(oxidanylidene)-1-(phenylmethyl)-1,3-diazinan-5-ylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [2-ethoxy-4-[(Z)-[2,4,6-tris(oxidanylidene)-1-(phenylmethyl)-1,3-diazinan-5-ylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [4-[(Z)-(1-benzyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methyl]-2-ethoxy-phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-ethoxy-4-[(Z)-[2,4,6-trioxo-1-(phenylmethyl)-1,3-diazinan-5-ylidene]methyl]phenyl] ester IUPAC Name: [4-[(Z)-(1-benzyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-ethoxyphenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[(Z)-(1-benzyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)methyl]-2-ethoxy-phenyl] ester Formula: C28H24N2O6 MolecularWeight: 484.49996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CC=C3)OC(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)NC(=O)N(C2=O)CC3=CC=CC=C3)OC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C28H24N2O6/c1-3-35-24-16-20(12-13-23(24)36-27(33)21-11-7-8-18(2)14-21)15-22-25(31)29-28(34)30(26(22)32)17-19-9-5-4-6-10-19/h4-16H,3,17H2,1-2H3,(H,29,31,34)/b22-15-