methyl sulfate; trimethyl-[2-[2-(phenylmethyl)phenoxy]ethyl]azanium

Systemtic Name: methyl sulfate; trimethyl-[2-[2-(phenylmethyl)phenoxy]ethyl]azanium Openeye Name: 2-(2-benzylphenoxy)ethyl-trimethyl-ammonium; methyl sulfate CAS Name: methyl sulfate; trimethyl-[2-[2-(phenylmethyl)phenoxy]ethyl]ammonium IUPAC Name: 2-(2-benzylphenoxy)ethyl-trimethylazanium; methyl sulfate Traditional Name: 2-(2-benzylphenoxy)ethyl-trimethyl-ammonium; methyl sulfate Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC1=CC=CC=C1CC2=CC=CC=C2.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CCOC1=CC=CC=C1CC2=CC=CC=C2.COS(=O)(=O)[O-]

InChI

InChI=1S/C18H24NO.CH4O4S/c1-19(2,3)13-14-20-18-12-8-7-11-17(18)15-16-9-5-4-6-10-16;1-5-6(2,3)4/h4-12H,13-15H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1