2-[(E)-2-[4-methoxy-3-(pyridin-2-ylmethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid

Systemtic Name: 2-[(E)-2-[4-methoxy-3-(pyridin-2-ylmethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid Openeye Name: 2-[(E)-2-[4-methoxy-3-(2-pyridylmethoxy)phenyl]vinyl]-1H-benzimidazole-4-carboxylic acid CAS Name: 2-[(E)-2-[4-methoxy-3-(2-pyridinylmethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid IUPAC Name: 2-[(E)-2-[4-methoxy-3-(pyridin-2-ylmethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid Traditional Name: 2-[(E)-2-[4-methoxy-3-(2-pyridylmethoxy)phenyl]vinyl]-1H-benzimidazole-4-carboxylic acid Formula: C23H19N3O4 MolecularWeight: 401.41466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC2=NC3=C(C=CC=C3N2)C(=O)O)OCC4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C2=NC3=C(C=CC=C3N2)C(=O)O)OCC4=CC=CC=N4

InChI

InChI=1S/C23H19N3O4/c1-29-19-10-8-15(13-20(19)30-14-16-5-2-3-12-24-16)9-11-21-25-18-7-4-6-17(23(27)28)22(18)26-21/h2-13H,14H2,1H3,(H,25,26)(H,27,28)/b11-9+