dimethyl-phenyl-(phenylmethyl)azanium; sulfonatooxy sulfate

Systemtic Name: dimethyl-phenyl-(phenylmethyl)azanium; sulfonatooxy sulfate Openeye Name: benzyl-dimethyl-phenyl-ammonium; sulfonatooxy sulfate CAS Name: dimethyl-phenyl-(phenylmethyl)ammonium; sulfonatooxy sulfate IUPAC Name: benzyl-dimethyl-phenylazanium; sulfonatooxy sulfate Traditional Name: benzyl-dimethyl-phenyl-ammonium; sulfato sulfate Formula: C30H36N2O8S2 MolecularWeight: 616.74544

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=CC=C1)C2=CC=CC=C2.C[N+](C)(CC1=CC=CC=C1)C2=CC=CC=C2.[O-]S(=O)(=O)OOS(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(CC1=CC=CC=C1)C2=CC=CC=C2.C[N+](C)(CC1=CC=CC=C1)C2=CC=CC=C2.[O-]S(=O)(=O)OOS(=O)(=O)[O-]

InChI

InChI=1S/2C15H18N.H2O8S2/c2*1-16(2,15-11-7-4-8-12-15)13-14-9-5-3-6-10-14;1-9(2,3)7-8-10(4,5)6/h2*3-12H,13H2,1-2H3;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2