[cyano-(4-methoxyphenyl)methyl]-trimethyl-azanium; methyl sulfate

Systemtic Name: [cyano-(4-methoxyphenyl)methyl]-trimethyl-azanium; methyl sulfate Openeye Name: [cyano-(4-methoxyphenyl)methyl]-trimethyl-ammonium; methyl sulfate CAS Name: [cyano-(4-methoxyphenyl)methyl]-trimethylammonium; methyl sulfate IUPAC Name: [cyano-(4-methoxyphenyl)methyl]-trimethylazanium; methyl sulfate Traditional Name: [cyano-(4-methoxyphenyl)methyl]-trimethyl-ammonium; methyl sulfate Formula: C13H20N2O5S MolecularWeight: 316.3733

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(C#N)C1=CC=C(C=C1)OC.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C)C(C#N)C1=CC=C(C=C1)OC.COS(=O)(=O)[O-]

InChI

InChI=1S/C12H17N2O.CH4O4S/c1-14(2,3)12(9-13)10-5-7-11(15-4)8-6-10;1-5-6(2,3)4/h5-8,12H,1-4H3;1H3,(H,2,3,4)/q+1;/p-1