2-pentadecyl-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-pentadecyl-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-pentadecyl-3H-benzimidazole-5-sulfonic acid CAS Name: 2-pentadecyl-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-pentadecyl-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-pentadecyl-3H-benzimidazole-5-sulfonic acid Formula: C22H36N2O3S MolecularWeight: 408.59784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C22H36N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-23-20-17-16-19(28(25,26)27)18-21(20)24-22/h16-18H,2-15H2,1H3,(H,23,24)(H,25,26,27)