4-[[5-methoxycarbonyl-4-methyl-2-oxidanylidene-6-(4-phenylphenyl)-1,6-dihydropyrimidin-3-yl]methyl]benzoic acid

Systemtic Name: 4-[[5-methoxycarbonyl-4-methyl-2-oxidanylidene-6-(4-phenylphenyl)-1,6-dihydropyrimidin-3-yl]methyl]benzoic acid Openeye Name: 4-[[5-methoxycarbonyl-4-methyl-2-oxo-6-(4-phenylphenyl)-1,6-dihydropyrimidin-3-yl]methyl]benzoic acid CAS Name: 4-[[5-methoxycarbonyl-4-methyl-2-oxo-6-(4-phenylphenyl)-1,6-dihydropyrimidin-3-yl]methyl]benzoic acid IUPAC Name: 4-[[5-methoxycarbonyl-4-methyl-2-oxo-6-(4-phenylphenyl)-1,6-dihydropyrimidin-3-yl]methyl]benzoic acid Traditional Name: 4-[[5-carbomethoxy-2-keto-4-methyl-6-(4-phenylphenyl)-1,6-dihydropyrimidin-3-yl]methyl]benzoic acid Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H24N2O5/c1-17-23(26(32)34-2)24(21-14-12-20(13-15-21)19-6-4-3-5-7-19)28-27(33)29(17)16-18-8-10-22(11-9-18)25(30)31/h3-15,24H,16H2,1-2H3,(H,28,33)(H,30,31)