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

Systemtic Name: 4-[5-methoxycarbonyl-4-methyl-6-[2-(4-nitrophenyl)carbonyloxyphenyl]-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoic acid Openeye Name: 4-[5-methoxycarbonyl-4-methyl-6-[2-(4-nitrobenzoyl)oxyphenyl]-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid CAS Name: 4-[5-methoxycarbonyl-4-methyl-6-[2-[(4-nitrophenyl)-oxomethoxy]phenyl]-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid IUPAC Name: 4-[5-methoxycarbonyl-4-methyl-6-[2-(4-nitrobenzoyl)oxyphenyl]-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid Traditional Name: 4-[5-carbomethoxy-2-keto-4-methyl-6-[2-(4-nitrobenzoyl)oxyphenyl]-1,6-dihydropyrimidin-3-yl]butyric acid Formula: C24H23N3O9 MolecularWeight: 497.45412

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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=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC=CC=C2OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C24H23N3O9/c1-14-20(23(31)35-2)21(25-24(32)26(14)13-5-8-19(28)29)17-6-3-4-7-18(17)36-22(30)15-9-11-16(12-10-15)27(33)34/h3-4,6-7,9-12,21H,5,8,13H2,1-2H3,(H,25,32)(H,28,29)