4-[(6R)-6-(2-chloranyl-6-fluoranyl-phenyl)-5-methoxycarbonyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoic acid

Systemtic Name: 4-[(6R)-6-(2-chloranyl-6-fluoranyl-phenyl)-5-methoxycarbonyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoic acid Openeye Name: 4-[(6R)-6-(2-chloro-6-fluoro-phenyl)-5-methoxycarbonyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid CAS Name: 4-[(6R)-6-(2-chloro-6-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid IUPAC Name: 4-[(6R)-6-(2-chloro-6-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid Traditional Name: 4-[(6R)-5-carbomethoxy-6-(2-chloro-6-fluoro-phenyl)-2-keto-4-methyl-1,6-dihydropyrimidin-3-yl]butyric acid Formula: C17H18ClFN2O5 MolecularWeight: 384.786623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=C(C=CC=C2Cl)F)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1CCCC(=O)O)C2=C(C=CC=C2Cl)F)C(=O)OC

InChI

InChI=1S/C17H18ClFN2O5/c1-9-13(16(24)26-2)15(14-10(18)5-3-6-11(14)19)20-17(25)21(9)8-4-7-12(22)23/h3,5-6,15H,4,7-8H2,1-2H3,(H,20,25)(H,22,23)/t15-/m1/s1