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

Systemtic Name: 2-[4-[[4-chloranyl-2-ethyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[4-chloro-2-ethyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[4-chloro-2-ethyl-5-(hydroxymethyl)-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[4-chloro-2-ethyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(4-chloro-2-ethyl-5-methylol-imidazol-1-yl)methyl]phenyl]benzoic acid Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CO)Cl

Isomeric SMILES

CCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CO)Cl

InChI

InChI=1S/C20H19ClN2O3/c1-2-18-22-19(21)17(12-24)23(18)11-13-7-9-14(10-8-13)15-5-3-4-6-16(15)20(25)26/h3-10,24H,2,11-12H2,1H3,(H,25,26)