methyl 3-[5-(2-cyanophenyl)-1-hexyl-benzimidazol-2-yl]propanoate

Systemtic Name: methyl 3-[5-(2-cyanophenyl)-1-hexyl-benzimidazol-2-yl]propanoate Openeye Name: methyl 3-[5-(2-cyanophenyl)-1-hexyl-benzimidazol-2-yl]propanoate CAS Name: 3-[5-(2-cyanophenyl)-1-hexyl-2-benzimidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-(2-cyanophenyl)-1-hexylbenzimidazol-2-yl]propanoate Traditional Name: 3-[5-(2-cyanophenyl)-1-hexyl-benzimidazol-2-yl]propionic acid methyl ester Formula: C24H27N3O2 MolecularWeight: 389.49008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3C#N)N=C1CCC(=O)OC

Isomeric SMILES

CCCCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3C#N)N=C1CCC(=O)OC

InChI

InChI=1S/C24H27N3O2/c1-3-4-5-8-15-27-22-12-11-18(20-10-7-6-9-19(20)17-25)16-21(22)26-23(27)13-14-24(28)29-2/h6-7,9-12,16H,3-5,8,13-15H2,1-2H3