5-aminocarbonyl-4-hexyl-imidazole-1-sulfonic acid

Systemtic Name: 5-aminocarbonyl-4-hexyl-imidazole-1-sulfonic acid Openeye Name: 5-carbamoyl-4-hexyl-imidazole-1-sulfonic acid CAS Name: 5-carbamoyl-4-hexyl-1-imidazolesulfonic acid IUPAC Name: 5-carbamoyl-4-hexylimidazole-1-sulfonic acid Traditional Name: 5-carbamoyl-4-hexyl-imidazole-1-sulfonic acid Formula: C10H17N3O4S MolecularWeight: 275.32468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N(C=N1)S(=O)(=O)O)C(=O)N

Isomeric SMILES

CCCCCCC1=C(N(C=N1)S(=O)(=O)O)C(=O)N

InChI

InChI=1S/C10H17N3O4S/c1-2-3-4-5-6-8-9(10(11)14)13(7-12-8)18(15,16)17/h7H,2-6H2,1H3,(H2,11,14)(H,15,16,17)