1-[4-(2-chloroethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[4-(2-chloroethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-[4-(2-chloroethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-[4-(2-chloroethyl)phenyl]sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-[4-(2-chloroethyl)phenyl]sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-[4-(2-chloroethyl)phenyl]sulfonyl-4-ethyl-piperazin-4-ium Formula: C14H22ClN2O2S+ MolecularWeight: 317.85468

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCCl

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCCl

InChI

InChI=1S/C14H21ClN2O2S/c1-2-16-9-11-17(12-10-16)20(18,19)14-5-3-13(4-6-14)7-8-15/h3-6H,2,7-12H2,1H3/p+1