4-[(4-dimethylaminophenyl)-(1,4-dimethylpiperazin-1-ium-1-yl)methyl]-N,N-dimethyl-aniline; methyl sulfate

Systemtic Name: 4-[(4-dimethylaminophenyl)-(1,4-dimethylpiperazin-1-ium-1-yl)methyl]-N,N-dimethyl-aniline; methyl sulfate Openeye Name: 4-[(4-dimethylaminophenyl)-(1,4-dimethylpiperazin-1-ium-1-yl)methyl]-N,N-dimethyl-aniline; methyl sulfate CAS Name: 4-[(4-dimethylaminophenyl)-(1,4-dimethyl-1-piperazin-1-iumyl)methyl]-N,N-dimethylaniline; methyl sulfate IUPAC Name: 4-[(4-dimethylaminophenyl)-(1,4-dimethylpiperazin-1-ium-1-yl)methyl]-N,N-dimethylaniline; methyl sulfate Traditional Name: [4-[(4-dimethylaminophenyl)-(1,4-dimethylpiperazin-1-ium-1-yl)methyl]phenyl]-dimethyl-amine; methyl sulfate Formula: C24H38N4O4S MolecularWeight: 478.64792

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](CC1)(C)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CN1CC[N+](CC1)(C)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C23H35N4.CH4O4S/c1-24(2)21-11-7-19(8-12-21)23(27(6)17-15-26(5)16-18-27)20-9-13-22(14-10-20)25(3)4;1-5-6(2,3)4/h7-14,23H,15-18H2,1-6H3;1H3,(H,2,3,4)/q+1;/p-1