2-[4-[[1-butyl-4-(hydroxymethyl)imidazol-2-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[1-butyl-4-(hydroxymethyl)imidazol-2-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[1-butyl-4-(hydroxymethyl)imidazol-2-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[1-butyl-4-(hydroxymethyl)-2-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[1-butyl-4-(hydroxymethyl)imidazol-2-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(1-butyl-4-methylol-imidazol-2-yl)methyl]phenyl]benzoic acid Formula: C22H24N2O3 MolecularWeight: 364.43756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(N=C1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CO

Isomeric SMILES

CCCCN1C=C(N=C1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CO

InChI

InChI=1S/C22H24N2O3/c1-2-3-12-24-14-18(15-25)23-21(24)13-16-8-10-17(11-9-16)19-6-4-5-7-20(19)22(26)27/h4-11,14,25H,2-3,12-13,15H2,1H3,(H,26,27)