1-(2-butoxy-4,5-dimethyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium

Systemtic Name: 1-(2-butoxy-4,5-dimethyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-(2-butoxy-4,5-dimethyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-(2-butoxy-4,5-dimethylphenyl)sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-(2-butoxy-4,5-dimethylphenyl)sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-(2-butoxy-4,5-dimethyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Formula: C17H29N2O3S+ MolecularWeight: 341.48876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)C)C)S(=O)(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)C)C)S(=O)(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C17H28N2O3S/c1-5-6-11-22-16-12-14(2)15(3)13-17(16)23(20,21)19-9-7-18(4)8-10-19/h12-13H,5-11H2,1-4H3/p+1