2-[2-(5-chloranyl-2-hexoxy-phenyl)benzimidazol-1-yl]ethanoate

Systemtic Name: 2-[2-(5-chloranyl-2-hexoxy-phenyl)benzimidazol-1-yl]ethanoate Openeye Name: 2-[2-(5-chloro-2-hexoxy-phenyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-(5-chloro-2-hexoxyphenyl)-1-benzimidazolyl]acetate IUPAC Name: 2-[2-(5-chloro-2-hexoxyphenyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-(5-chloro-2-hexoxy-phenyl)benzimidazol-1-yl]acetate Formula: C21H22ClN2O3- MolecularWeight: 385.86398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Cl)C2=NC3=CC=CC=C3N2CC(=O)[O-]

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Cl)C2=NC3=CC=CC=C3N2CC(=O)[O-]

InChI

InChI=1S/C21H23ClN2O3/c1-2-3-4-7-12-27-19-11-10-15(22)13-16(19)21-23-17-8-5-6-9-18(17)24(21)14-20(25)26/h5-6,8-11,13H,2-4,7,12,14H2,1H3,(H,25,26)/p-1