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

Systemtic Name: 1-(2-butoxy-5-chloranyl-4-methyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-(2-butoxy-5-chloro-4-methyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-(2-butoxy-5-chloro-4-methylphenyl)sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-(2-butoxy-5-chloro-4-methylphenyl)sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-(2-butoxy-5-chloro-4-methyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Formula: C16H26ClN2O3S+ MolecularWeight: 361.90724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN2O3S/c1-4-5-10-22-15-11-13(2)14(17)12-16(15)23(20,21)19-8-6-18(3)7-9-19/h11-12H,4-10H2,1-3H3/p+1