2-[4-[(3,4-dichlorophenyl)-oxidanyl-methyl]phenyl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[(3,4-dichlorophenyl)-oxidanyl-methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[(3,4-dichlorophenyl)-hydroxy-methyl]phenyl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[(3,4-dichlorophenyl)-hydroxymethyl]phenyl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[4-[(3,4-dichlorophenyl)-hydroxymethyl]phenyl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[4-[(3,4-dichlorophenyl)-hydroxy-methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Formula: C21H14Cl2N2O3 MolecularWeight: 413.25346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)C(C4=CC(=C(C=C4)Cl)Cl)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)C(C4=CC(=C(C=C4)Cl)Cl)O

InChI

InChI=1S/C21H14Cl2N2O3/c22-15-7-5-13(9-16(15)23)19(26)11-1-3-12(4-2-11)20-24-17-8-6-14(21(27)28)10-18(17)25-20/h1-10,19,26H,(H,24,25)(H,27,28)