methyl hydrogen sulfate; 1,2,3-trimethyl-2H-benzimidazole

Systemtic Name: methyl hydrogen sulfate; 1,2,3-trimethyl-2H-benzimidazole Openeye Name: methyl hydrogen sulfate; 1,2,3-trimethyl-2H-benzimidazole CAS Name: sulfuric acid methyl ester; 1,2,3-trimethyl-2H-benzimidazole IUPAC Name: methyl hydrogen sulfate; 1,2,3-trimethyl-2H-benzimidazole Traditional Name: sulfuric acid methyl ester; 1,2,3-trimethyl-2H-benzimidazole Formula: C11H18N2O4S MolecularWeight: 274.33662

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=CC=CC=C2N1C)C.COS(=O)(=O)O

Isomeric SMILES

CC1N(C2=CC=CC=C2N1C)C.COS(=O)(=O)O

InChI

InChI=1S/C10H14N2.CH4O4S/c1-8-11(2)9-6-4-5-7-10(9)12(8)3;1-5-6(2,3)4/h4-8H,1-3H3;1H3,(H,2,3,4)