2-[[4-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]phenoxy]methyl]benzoic acid

Systemtic Name: 2-[[4-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]phenoxy]methyl]benzoic acid Openeye Name: 2-[[4-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]phenoxy]methyl]benzoic acid CAS Name: 2-[[4-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]phenoxy]methyl]benzoic acid IUPAC Name: 2-[[4-[[2-butyl-4-(hydroxymethyl)-1H-imidazol-5-yl]methyl]phenoxy]methyl]benzoic acid Traditional Name: 2-[[4-[(2-butyl-4-methylol-1H-imidazol-5-yl)methyl]phenoxy]methyl]benzoic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)CC2=CC=C(C=C2)OCC3=CC=CC=C3C(=O)O)CO

Isomeric SMILES

CCCCC1=NC(=C(N1)CC2=CC=C(C=C2)OCC3=CC=CC=C3C(=O)O)CO

InChI

InChI=1S/C23H26N2O4/c1-2-3-8-22-24-20(21(14-26)25-22)13-16-9-11-18(12-10-16)29-15-17-6-4-5-7-19(17)23(27)28/h4-7,9-12,26H,2-3,8,13-15H2,1H3,(H,24,25)(H,27,28)