dimethyl-(phenylmethyl)-[3-(propan-2-ylsulfonylamino)propyl]azanium chloride

Systemtic Name: dimethyl-(phenylmethyl)-[3-(propan-2-ylsulfonylamino)propyl]azanium chloride Openeye Name: benzyl-[3-(isopropylsulfonylamino)propyl]-dimethyl-ammonium chloride CAS Name: dimethyl-(phenylmethyl)-[3-(propan-2-ylsulfonylamino)propyl]ammonium chloride IUPAC Name: benzyl-dimethyl-[3-(propan-2-ylsulfonylamino)propyl]azanium chloride Traditional Name: benzyl-[3-(isopropylsulfonylamino)propyl]-dimethyl-ammonium chloride Formula: C15H27ClN2O2S MolecularWeight: 334.90508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CC(C)S(=O)(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C15H27N2O2S.ClH/c1-14(2)20(18,19)16-11-8-12-17(3,4)13-15-9-6-5-7-10-15;/h5-7,9-10,14,16H,8,11-13H2,1-4H3;1H/q+1;/p-1