2-(1-octylbenzimidazol-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(1-octylbenzimidazol-2-yl)sulfanylethanoic acid Openeye Name: 2-(1-octylbenzimidazol-2-yl)sulfanylacetic acid CAS Name: 2-[(1-octyl-2-benzimidazolyl)thio]acetic acid IUPAC Name: 2-(1-octylbenzimidazol-2-yl)sulfanylacetic acid Traditional Name: 2-[(1-octylbenzimidazol-2-yl)thio]acetic acid Formula: C17H24N2O2S MolecularWeight: 320.44966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2N=C1SCC(=O)O

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2N=C1SCC(=O)O

InChI

InChI=1S/C17H24N2O2S/c1-2-3-4-5-6-9-12-19-15-11-8-7-10-14(15)18-17(19)22-13-16(20)21/h7-8,10-11H,2-6,9,12-13H2,1H3,(H,20,21)