9-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]carbonyloxynonanoic acid

Systemtic Name: 9-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]carbonyloxynonanoic acid Openeye Name: 9-(2-thiazol-4-ylbenzimidazole-1-carbonyl)oxynonanoic acid CAS Name: 9-[oxo-[2-(4-thiazolyl)-1-benzimidazolyl]methoxy]nonanoic acid IUPAC Name: 9-[2-(1,3-thiazol-4-yl)benzimidazole-1-carbonyl]oxynonanoic acid Traditional Name: 9-(2-thiazol-4-ylbenzimidazole-1-carbonyl)oxypelargonic acid Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2C(=O)OCCCCCCCCC(=O)O)C3=CSC=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2C(=O)OCCCCCCCCC(=O)O)C3=CSC=N3

InChI

InChI=1S/C20H23N3O4S/c24-18(25)11-5-3-1-2-4-8-12-27-20(26)23-17-10-7-6-9-15(17)22-19(23)16-13-28-14-21-16/h6-7,9-10,13-14H,1-5,8,11-12H2,(H,24,25)