methyl 4-[[3-(4-ethoxyphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[3-(4-ethoxyphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[3-(4-ethoxyphenyl)-2,4-dioxo-1H-pyrimidine-5-carbonyl]amino]benzoate CAS Name: 4-[[[3-(4-ethoxyphenyl)-2,4-dioxo-1H-pyrimidin-5-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-ethoxyphenyl)-2,4-dioxo-1H-pyrimidine-5-carbonyl]amino]benzoate Traditional Name: 4-[(2,4-diketo-3-p-phenetyl-1H-pyrimidine-5-carbonyl)amino]benzoic acid methyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H19N3O6/c1-3-30-16-10-8-15(9-11-16)24-19(26)17(12-22-21(24)28)18(25)23-14-6-4-13(5-7-14)20(27)29-2/h4-12H,3H2,1-2H3,(H,22,28)(H,23,25)