1-ethyl-2-undecyl-benzimidazole-5-sulfonic acid

Systemtic Name: 1-ethyl-2-undecyl-benzimidazole-5-sulfonic acid Openeye Name: 1-ethyl-2-undecyl-benzimidazole-5-sulfonic acid CAS Name: 1-ethyl-2-undecyl-5-benzimidazolesulfonic acid IUPAC Name: 1-ethyl-2-undecylbenzimidazole-5-sulfonic acid Traditional Name: 1-ethyl-2-undecyl-benzimidazole-5-sulfonic acid Formula: C20H32N2O3S MolecularWeight: 380.54468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCC1=NC2=C(N1CC)C=CC(=C2)S(=O)(=O)O

InChI

InChI=1S/C20H32N2O3S/c1-3-5-6-7-8-9-10-11-12-13-20-21-18-16-17(26(23,24)25)14-15-19(18)22(20)4-2/h14-16H,3-13H2,1-2H3,(H,23,24,25)