3-[[2-chloranyl-4-[phenyl(phenylmethoxy)methyl]phenyl]methyl]-2-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 3-[[2-chloranyl-4-[phenyl(phenylmethoxy)methyl]phenyl]methyl]-2-methyl-benzimidazole-5-carboxylic acid Openeye Name: 3-[[4-[benzyloxy(phenyl)methyl]-2-chloro-phenyl]methyl]-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 3-[[2-chloro-4-[phenyl(phenylmethoxy)methyl]phenyl]methyl]-2-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 3-[[2-chloro-4-[phenyl(phenylmethoxy)methyl]phenyl]methyl]-2-methylbenzimidazole-5-carboxylic acid Traditional Name: 3-[4-[benzoxy(phenyl)methyl]-2-chloro-benzyl]-2-methyl-benzimidazole-5-carboxylic acid Formula: C30H25ClN2O3 MolecularWeight: 496.9841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)C(C4=CC=CC=C4)OCC5=CC=CC=C5)Cl)C=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)C(C4=CC=CC=C4)OCC5=CC=CC=C5)Cl)C=C(C=C2)C(=O)O

InChI

InChI=1S/C30H25ClN2O3/c1-20-32-27-15-14-24(30(34)35)17-28(27)33(20)18-25-13-12-23(16-26(25)31)29(22-10-6-3-7-11-22)36-19-21-8-4-2-5-9-21/h2-17,29H,18-19H2,1H3,(H,34,35)