4-[5-ethoxycarbonyl-6-(3-ethoxy-4-oxidanyl-phenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]benzoic acid

Systemtic Name: 4-[5-ethoxycarbonyl-6-(3-ethoxy-4-oxidanyl-phenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]benzoic acid Openeye Name: 4-[5-ethoxycarbonyl-6-(3-ethoxy-4-hydroxy-phenyl)-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid CAS Name: 4-[5-ethoxycarbonyl-6-(3-ethoxy-4-hydroxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid IUPAC Name: 4-[5-ethoxycarbonyl-6-(3-ethoxy-4-hydroxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]benzoic acid Traditional Name: 4-[5-carbethoxy-6-(3-ethoxy-4-hydroxy-phenyl)-2-keto-4-methyl-1,6-dihydropyrimidin-3-yl]benzoic acid Formula: C23H24N2O7 MolecularWeight: 440.44586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=O)N2)C3=CC=C(C=C3)C(=O)O)C)C(=O)OCC)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=O)N2)C3=CC=C(C=C3)C(=O)O)C)C(=O)OCC)O

InChI

InChI=1S/C23H24N2O7/c1-4-31-18-12-15(8-11-17(18)26)20-19(22(29)32-5-2)13(3)25(23(30)24-20)16-9-6-14(7-10-16)21(27)28/h6-12,20,26H,4-5H2,1-3H3,(H,24,30)(H,27,28)