ethyl 1-ethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[(E)-2-(4-isopentyloxyphenyl)vinyl]benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]benzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[(E)-2-(4-isoamoxyphenyl)vinyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1C=CC3=CC=C(C=C3)OCCC(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1/C=C/C3=CC=C(C=C3)OCCC(C)C

InChI

InChI=1S/C25H30N2O3/c1-5-27-23-13-10-20(25(28)29-6-2)17-22(23)26-24(27)14-9-19-7-11-21(12-8-19)30-16-15-18(3)4/h7-14,17-18H,5-6,15-16H2,1-4H3/b14-9+