6-[3-(3-methoxypropyl)-2-pyridin-3-yl-benzimidazol-5-yl]oxyhexanoic acid

Systemtic Name: 6-[3-(3-methoxypropyl)-2-pyridin-3-yl-benzimidazol-5-yl]oxyhexanoic acid Openeye Name: 6-[3-(3-methoxypropyl)-2-(3-pyridyl)benzimidazol-5-yl]oxyhexanoic acid CAS Name: 6-[[3-(3-methoxypropyl)-2-(3-pyridinyl)-5-benzimidazolyl]oxy]hexanoic acid IUPAC Name: 6-[3-(3-methoxypropyl)-2-pyridin-3-ylbenzimidazol-5-yl]oxyhexanoic acid Traditional Name: 6-[3-(3-methoxypropyl)-2-(3-pyridyl)benzimidazol-5-yl]oxyhexanoic acid Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C2=C(C=CC(=C2)OCCCCCC(=O)O)N=C1C3=CN=CC=C3

Isomeric SMILES

COCCCN1C2=C(C=CC(=C2)OCCCCCC(=O)O)N=C1C3=CN=CC=C3

InChI

InChI=1S/C22H27N3O4/c1-28-13-6-12-25-20-15-18(29-14-4-2-3-8-21(26)27)9-10-19(20)24-22(25)17-7-5-11-23-16-17/h5,7,9-11,15-16H,2-4,6,8,12-14H2,1H3,(H,26,27)