2-butyl-1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-methyl-6-oxidanylidene-pyrimidine-4-carboxylic acid

Systemtic Name: 2-butyl-1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-methyl-6-oxidanylidene-pyrimidine-4-carboxylic acid Openeye Name: 2-butyl-1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-methyl-6-oxo-pyrimidine-4-carboxylic acid CAS Name: 2-butyl-1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-methyl-6-oxo-4-pyrimidinecarboxylic acid IUPAC Name: 2-butyl-1-[[4-(2-carboxyphenyl)phenyl]methyl]-5-methyl-6-oxopyrimidine-4-carboxylic acid Traditional Name: 2-butyl-1-[4-(2-carboxyphenyl)benzyl]-6-keto-5-methyl-pyrimidine-4-carboxylic acid Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C)C(=O)O

Isomeric SMILES

CCCCC1=NC(=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C)C(=O)O

InChI

InChI=1S/C24H24N2O5/c1-3-4-9-20-25-21(24(30)31)15(2)22(27)26(20)14-16-10-12-17(13-11-16)18-7-5-6-8-19(18)23(28)29/h5-8,10-13H,3-4,9,14H2,1-2H3,(H,28,29)(H,30,31)