5-[[4-(hydroxymethyl)-5-methyl-1-propan-2-yl-imidazol-2-yl]methyl]-2-phenyl-benzoic acid hydrochloride

Systemtic Name: 5-[[4-(hydroxymethyl)-5-methyl-1-propan-2-yl-imidazol-2-yl]methyl]-2-phenyl-benzoic acid hydrochloride Openeye Name: 5-[[4-(hydroxymethyl)-1-isopropyl-5-methyl-imidazol-2-yl]methyl]-2-phenyl-benzoic acid hydrochloride CAS Name: 5-[[4-(hydroxymethyl)-5-methyl-1-propan-2-yl-2-imidazolyl]methyl]-2-phenylbenzoic acid hydrochloride IUPAC Name: 5-[[4-(hydroxymethyl)-5-methyl-1-propan-2-ylimidazol-2-yl]methyl]-2-phenylbenzoic acid hydrochloride Traditional Name: 5-[(1-isopropyl-5-methyl-4-methylol-imidazol-2-yl)methyl]-2-phenyl-benzoic acid hydrochloride Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1C(C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)CO.Cl

Isomeric SMILES

CC1=C(N=C(N1C(C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)CO.Cl

InChI

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