6-[3-(3,4-dimethoxyphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid

Systemtic Name: 6-[3-(3,4-dimethoxyphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid Openeye Name: 6-[3-(3,4-dimethoxyphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid CAS Name: 6-[[3-(3,4-dimethoxyphenyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid IUPAC Name: 6-[3-(3,4-dimethoxyphenyl)-2-phenylbenzimidazol-5-yl]oxyhexanoic acid Traditional Name: 6-[3-(3,4-dimethoxyphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)O)N=C2C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)O)N=C2C4=CC=CC=C4)OC

InChI

InChI=1S/C27H28N2O5/c1-32-24-15-12-20(17-25(24)33-2)29-23-18-21(34-16-8-4-7-11-26(30)31)13-14-22(23)28-27(29)19-9-5-3-6-10-19/h3,5-6,9-10,12-15,17-18H,4,7-8,11,16H2,1-2H3,(H,30,31)