dimethyl-bis(phenylmethyl)azanium; ethanesulfonate

Systemtic Name: dimethyl-bis(phenylmethyl)azanium; ethanesulfonate Openeye Name: dibenzyl(dimethyl)ammonium; ethanesulfonate CAS Name: dimethyl-bis(phenylmethyl)ammonium; ethanesulfonate IUPAC Name: dibenzyl(dimethyl)azanium; ethanesulfonate Traditional Name: dibenzyl(dimethyl)ammonium esylate Formula: C18H25NO3S MolecularWeight: 335.461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)[O-].C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)[O-].C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N.C2H6O3S/c1-17(2,13-15-9-5-3-6-10-15)14-16-11-7-4-8-12-16;1-2-6(3,4)5/h3-12H,13-14H2,1-2H3;2H2,1H3,(H,3,4,5)/q+1;/p-1