2-[(4-chlorophenyl)sulfonyl-(phenylmethyl)sulfonyl-amino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-(phenylmethyl)sulfonyl-amino]ethyl-diethyl-azanium chloride Openeye Name: 2-[benzylsulfonyl-(4-chlorophenyl)sulfonyl-amino]ethyl-diethyl-ammonium chloride CAS Name: 2-[(4-chlorophenyl)sulfonyl-(phenylmethyl)sulfonylamino]ethyl-diethylammonium chloride IUPAC Name: 2-[benzylsulfonyl-(4-chlorophenyl)sulfonylamino]ethyl-diethylazanium chloride Traditional Name: 2-[benzylsulfonyl-(4-chlorophenyl)sulfonyl-amino]ethyl-diethyl-ammonium chloride Formula: C19H26Cl2N2O4S2 MolecularWeight: 481.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(S(=O)(=O)CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCN(S(=O)(=O)CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C19H25ClN2O4S2.ClH/c1-3-21(4-2)14-15-22(27(23,24)16-17-8-6-5-7-9-17)28(25,26)19-12-10-18(20)11-13-19;/h5-13H,3-4,14-16H2,1-2H3;1H