8-[3-(3-chlorophenyl)-2-oxidanylidene-benzimidazol-1-yl]octanoic acid

Systemtic Name: 8-[3-(3-chlorophenyl)-2-oxidanylidene-benzimidazol-1-yl]octanoic acid Openeye Name: 8-[3-(3-chlorophenyl)-2-oxo-benzimidazol-1-yl]octanoic acid CAS Name: 8-[3-(3-chlorophenyl)-2-oxo-1-benzimidazolyl]octanoic acid IUPAC Name: 8-[3-(3-chlorophenyl)-2-oxobenzimidazol-1-yl]octanoic acid Traditional Name: 8-[3-(3-chlorophenyl)-2-keto-benzimidazol-1-yl]caprylic acid Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)N2C3=CC(=CC=C3)Cl)CCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)N2C3=CC(=CC=C3)Cl)CCCCCCCC(=O)O

InChI

InChI=1S/C21H23ClN2O3/c22-16-9-8-10-17(15-16)24-19-12-6-5-11-18(19)23(21(24)27)14-7-3-1-2-4-13-20(25)26/h5-6,8-12,15H,1-4,7,13-14H2,(H,25,26)