5-[(4-butyl-1,2-dimethyl-6-oxidanylidene-pyrimidin-5-yl)methyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[(4-butyl-1,2-dimethyl-6-oxidanylidene-pyrimidin-5-yl)methyl]-2-phenyl-benzoic acid Openeye Name: 5-[(4-butyl-1,2-dimethyl-6-oxo-pyrimidin-5-yl)methyl]-2-phenyl-benzoic acid CAS Name: 5-[(4-butyl-1,2-dimethyl-6-oxo-5-pyrimidinyl)methyl]-2-phenylbenzoic acid IUPAC Name: 5-[(4-butyl-1,2-dimethyl-6-oxopyrimidin-5-yl)methyl]-2-phenylbenzoic acid Traditional Name: 5-[(4-butyl-6-keto-1,2-dimethyl-pyrimidin-5-yl)methyl]-2-phenyl-benzoic acid Formula: C24H26N2O3 MolecularWeight: 390.47484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C(=N1)C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCC1=C(C(=O)N(C(=N1)C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H26N2O3/c1-4-5-11-22-21(23(27)26(3)16(2)25-22)15-17-12-13-19(20(14-17)24(28)29)18-9-7-6-8-10-18/h6-10,12-14H,4-5,11,15H2,1-3H3,(H,28,29)