methyl hydrogen sulfate; N,N,2-trimethylquinolin-6-amine

Systemtic Name: methyl hydrogen sulfate; N,N,2-trimethylquinolin-6-amine Openeye Name: methyl hydrogen sulfate; N,N,2-trimethylquinolin-6-amine CAS Name: sulfuric acid methyl ester; N,N,2-trimethyl-6-quinolinamine IUPAC Name: methyl hydrogen sulfate; N,N,2-trimethylquinolin-6-amine Traditional Name: dimethyl-(2-methyl-6-quinolyl)amine; sulfuric acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)N(C)C.COS(=O)(=O)O

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)N(C)C.COS(=O)(=O)O

InChI

InChI=1S/C12H14N2.CH4O4S/c1-9-4-5-10-8-11(14(2)3)6-7-12(10)13-9;1-5-6(2,3)4/h4-8H,1-3H3;1H3,(H,2,3,4)