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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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