6-[4-methyl-2-oxidanylidene-5-phenylmethoxycarbonyl-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-3-yl]hexanoic acid

Systemtic Name: 6-[4-methyl-2-oxidanylidene-5-phenylmethoxycarbonyl-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-3-yl]hexanoic acid Openeye Name: 6-[5-benzyloxycarbonyl-4-methyl-2-oxo-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-3-yl]hexanoic acid CAS Name: 6-[4-methyl-2-oxo-5-phenylmethoxycarbonyl-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-3-yl]hexanoic acid IUPAC Name: 6-[4-methyl-2-oxo-5-phenylmethoxycarbonyl-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-3-yl]hexanoic acid Traditional Name: 6-[5-carbobenzoxy-2-keto-4-methyl-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-3-yl]hexanoic acid Formula: C26H27F3N2O5 MolecularWeight: 504.49819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCCCC(=O)O)C2=CC=C(C=C2)C(F)(F)F)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCCCC(=O)O)C2=CC=C(C=C2)C(F)(F)F)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H27F3N2O5/c1-17-22(24(34)36-16-18-8-4-2-5-9-18)23(19-11-13-20(14-12-19)26(27,28)29)30-25(35)31(17)15-7-3-6-10-21(32)33/h2,4-5,8-9,11-14,23H,3,6-7,10,15-16H2,1H3,(H,30,35)(H,32,33)