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

Systemtic Name: 2-[4-[oxidanyl(pyridin-4-yl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[hydroxy(4-pyridyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[hydroxy(pyridin-4-yl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[4-[hydroxy(pyridin-4-yl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[4-[hydroxy(4-pyridyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Formula: C20H15N3O3 MolecularWeight: 345.3514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O3/c24-18(13-7-9-21-10-8-13)12-1-3-14(4-2-12)19-22-16-6-5-15(20(25)26)11-17(16)23-19/h1-11,18,24H,(H,22,23)(H,25,26)