2-[[[ethyl(phenyl)amino]-phenyl-methyl]sulfonylamino]ethyl-trimethyl-azanium; methanesulfonate

Systemtic Name: 2-[[[ethyl(phenyl)amino]-phenyl-methyl]sulfonylamino]ethyl-trimethyl-azanium; methanesulfonate Openeye Name: 2-[[(N-ethylanilino)-phenyl-methyl]sulfonylamino]ethyl-trimethyl-ammonium; methanesulfonate CAS Name: 2-[[(N-ethylanilino)-phenylmethyl]sulfonylamino]ethyl-trimethylammonium; methanesulfonate IUPAC Name: 2-[[(N-ethylanilino)-phenylmethyl]sulfonylamino]ethyl-trimethylazanium; methanesulfonate Traditional Name: 2-[[(N-ethylanilino)-phenyl-methyl]sulfonylamino]ethyl-trimethyl-ammonium mesylate Formula: C21H33N3O5S2 MolecularWeight: 471.63382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(C2=CC=CC=C2)S(=O)(=O)NCC[N+](C)(C)C.CS(=O)(=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)C(C2=CC=CC=C2)S(=O)(=O)NCC[N+](C)(C)C.CS(=O)(=O)[O-]

InChI

InChI=1S/C20H30N3O2S.CH4O3S/c1-5-22(19-14-10-7-11-15-19)20(18-12-8-6-9-13-18)26(24,25)21-16-17-23(2,3)4;1-5(2,3)4/h6-15,20-21H,5,16-17H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1