2-[(E)-2-(4-prop-2-ynoxyphenyl)ethenyl]-1H-benzimidazole-4-carboxylate

Systemtic Name: 2-[(E)-2-(4-prop-2-ynoxyphenyl)ethenyl]-1H-benzimidazole-4-carboxylate Openeye Name: 2-[(E)-2-(4-prop-2-ynoxyphenyl)vinyl]-1H-benzimidazole-4-carboxylate CAS Name: 2-[(E)-2-(4-prop-2-ynoxyphenyl)ethenyl]-1H-benzimidazole-4-carboxylate IUPAC Name: 2-[(E)-2-(4-prop-2-ynoxyphenyl)ethenyl]-1H-benzimidazole-4-carboxylate Traditional Name: 2-[(E)-2-(4-propargyloxyphenyl)vinyl]-1H-benzimidazole-4-carboxylate Formula: C19H13N2O3- MolecularWeight: 317.31812

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=C(C=C1)C=CC2=NC3=C(C=CC=C3N2)C(=O)[O-]

Isomeric SMILES

C#CCOC1=CC=C(C=C1)/C=C/C2=NC3=C(C=CC=C3N2)C(=O)[O-]

InChI

InChI=1S/C19H14N2O3/c1-2-12-24-14-9-6-13(7-10-14)8-11-17-20-16-5-3-4-15(19(22)23)18(16)21-17/h1,3-11H,12H2,(H,20,21)(H,22,23)/p-1/b11-8+