N1-[(4-bromophenyl)methyl]-N4,N4-diethyl-N1-methyl-benzene-1,4-disulfonamide

Systemtic Name: N1-[(4-bromophenyl)methyl]-N4,N4-diethyl-N1-methyl-benzene-1,4-disulfonamide Openeye Name: N1-[(4-bromophenyl)methyl]-N4,N4-diethyl-N1-methyl-benzene-1,4-disulfonamide CAS Name: N1-[(4-bromophenyl)methyl]-N4,N4-diethyl-N1-methylbenzene-1,4-disulfonamide IUPAC Name: 1-N-[(4-bromophenyl)methyl]-4-N,4-N-diethyl-1-N-methylbenzene-1,4-disulfonamide Traditional Name: N-(4-bromobenzyl)-N',N'-diethyl-N-methyl-benzene-1,4-disulfonamide Formula: C18H23BrN2O4S2 MolecularWeight: 475.42022

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H23BrN2O4S2/c1-4-21(5-2)27(24,25)18-12-10-17(11-13-18)26(22,23)20(3)14-15-6-8-16(19)9-7-15/h6-13H,4-5,14H2,1-3H3