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

Systemtic Name: 2-heptadecyl-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-heptadecyl-3H-benzimidazole-5-sulfonic acid CAS Name: 2-heptadecyl-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-heptadecyl-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-heptadecyl-3H-benzimidazole-5-sulfonic acid Formula: C24H40N2O3S MolecularWeight: 436.651

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C24H40N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-25-22-19-18-21(30(27,28)29)20-23(22)26-24/h18-20H,2-17H2,1H3,(H,25,26)(H,27,28,29)