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

Systemtic Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)ethenyl]-1H-benzimidazole-4-carboxylic acid Openeye Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)vinyl]-1H-benzimidazole-4-carboxylic acid CAS Name: 2-[(E)-2-(4-ethoxy-3-methoxyphenyl)ethenyl]-1H-benzimidazole-4-carboxylic acid IUPAC Name: 2-[(E)-2-(4-ethoxy-3-methoxyphenyl)ethenyl]-1H-benzimidazole-4-carboxylic acid Traditional Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)vinyl]-1H-benzimidazole-4-carboxylic acid Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC2=NC3=C(C=CC=C3N2)C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C2=NC3=C(C=CC=C3N2)C(=O)O)OC

InChI

InChI=1S/C19H18N2O4/c1-3-25-15-9-7-12(11-16(15)24-2)8-10-17-20-14-6-4-5-13(19(22)23)18(14)21-17/h4-11H,3H2,1-2H3,(H,20,21)(H,22,23)/b10-8+