1-(dimethylamino)-5-methanoyl-2-propyl-imidazole-4-sulfonic acid

Systemtic Name: 1-(dimethylamino)-5-methanoyl-2-propyl-imidazole-4-sulfonic acid Openeye Name: 1-(dimethylamino)-5-formyl-2-propyl-imidazole-4-sulfonic acid CAS Name: 1-(dimethylamino)-5-formyl-2-propyl-4-imidazolesulfonic acid IUPAC Name: 1-(dimethylamino)-5-formyl-2-propylimidazole-4-sulfonic acid Traditional Name: 1-(dimethylamino)-5-formyl-2-propyl-imidazole-4-sulfonic acid Formula: C9H15N3O4S MolecularWeight: 261.2981

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1N(C)C)C=O)S(=O)(=O)O

Isomeric SMILES

CCCC1=NC(=C(N1N(C)C)C=O)S(=O)(=O)O

InChI

InChI=1S/C9H15N3O4S/c1-4-5-8-10-9(17(14,15)16)7(6-13)12(8)11(2)3/h6H,4-5H2,1-3H3,(H,14,15,16)