2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]-6-methyl-benzoic acid

Systemtic Name: 2-[4-[[2-butyl-4-chloranyl-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]-6-methyl-benzoic acid Openeye Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]-6-methyl-benzoic acid CAS Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)-1-imidazolyl]methyl]phenyl]-6-methylbenzoic acid IUPAC Name: 2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]-6-methylbenzoic acid Traditional Name: 2-[4-[(2-butyl-4-chloro-5-methylol-imidazol-1-yl)methyl]phenyl]-6-methyl-benzoic acid Formula: C23H25ClN2O3 MolecularWeight: 412.9092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(C(=CC=C3)C)C(=O)O)CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=C(C(=CC=C3)C)C(=O)O)CO)Cl

InChI

InChI=1S/C23H25ClN2O3/c1-3-4-8-20-25-22(24)19(14-27)26(20)13-16-9-11-17(12-10-16)18-7-5-6-15(2)21(18)23(28)29/h5-7,9-12,27H,3-4,8,13-14H2,1-2H3,(H,28,29)