2-[3-[[2-butyl-4-chloranyl-5-(methoxymethyl)imidazol-1-yl]methyl]phenyl]carbonylbenzoic acid

Systemtic Name: 2-[3-[[2-butyl-4-chloranyl-5-(methoxymethyl)imidazol-1-yl]methyl]phenyl]carbonylbenzoic acid Openeye Name: 2-[3-[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-1-yl]methyl]benzoyl]benzoic acid CAS Name: 2-[[3-[[2-butyl-4-chloro-5-(methoxymethyl)-1-imidazolyl]methyl]phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[3-[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-1-yl]methyl]benzoyl]benzoic acid Traditional Name: 2-[3-[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-1-yl]methyl]benzoyl]benzoic acid Formula: C24H25ClN2O4 MolecularWeight: 440.9193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=CC(=C2)C(=O)C3=CC=CC=C3C(=O)O)COC)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=CC(=C2)C(=O)C3=CC=CC=C3C(=O)O)COC)Cl

InChI

InChI=1S/C24H25ClN2O4/c1-3-4-12-21-26-23(25)20(15-31-2)27(21)14-16-8-7-9-17(13-16)22(28)18-10-5-6-11-19(18)24(29)30/h5-11,13H,3-4,12,14-15H2,1-2H3,(H,29,30)