4-[6-[2-(3-iodanylphenyl)carbonyloxyphenyl]-5-methoxycarbonyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoic acid

Systemtic Name: 4-[6-[2-(3-iodanylphenyl)carbonyloxyphenyl]-5-methoxycarbonyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoic acid Openeye Name: 4-[6-[2-(3-iodobenzoyl)oxyphenyl]-5-methoxycarbonyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid CAS Name: 4-[6-[2-[(3-iodophenyl)-oxomethoxy]phenyl]-5-methoxycarbonyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid IUPAC Name: 4-[6-[2-(3-iodobenzoyl)oxyphenyl]-5-methoxycarbonyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid Traditional Name: 4-[5-carbomethoxy-6-[2-(3-iodobenzoyl)oxyphenyl]-2-keto-4-methyl-1,6-dihydropyrimidin-3-yl]butyric acid Formula: C24H23IN2O7 MolecularWeight: 578.35309

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)I)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)I)C(=O)OC

InChI

InChI=1S/C24H23IN2O7/c1-14-20(23(31)33-2)21(26-24(32)27(14)12-6-11-19(28)29)17-9-3-4-10-18(17)34-22(30)15-7-5-8-16(25)13-15/h3-5,7-10,13,21H,6,11-12H2,1-2H3,(H,26,32)(H,28,29)