1-[4-bromanyl-2,6-bis(chloranyl)phenyl]sulfonyl-4-prop-2-enyl-piperazin-4-ium

Systemtic Name: 1-[4-bromanyl-2,6-bis(chloranyl)phenyl]sulfonyl-4-prop-2-enyl-piperazin-4-ium Openeye Name: 1-allyl-4-(4-bromo-2,6-dichloro-phenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(4-bromo-2,6-dichlorophenyl)sulfonyl-4-prop-2-enylpiperazin-4-ium IUPAC Name: 1-(4-bromo-2,6-dichlorophenyl)sulfonyl-4-prop-2-enylpiperazin-4-ium Traditional Name: 1-allyl-4-(4-bromo-2,6-dichloro-phenyl)sulfonyl-piperazin-1-ium Formula: C13H16BrCl2N2O2S+ MolecularWeight: 415.15334

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2Cl)Br)Cl

Isomeric SMILES

C=CC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2Cl)Br)Cl

InChI

InChI=1S/C13H15BrCl2N2O2S/c1-2-3-17-4-6-18(7-5-17)21(19,20)13-11(15)8-10(14)9-12(13)16/h2,8-9H,1,3-7H2/p+1