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

Systemtic Name: 1-[4-(2-chloranylphenoxy)phenyl]sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-[4-(2-chlorophenoxy)phenyl]sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-[4-(2-chlorophenoxy)phenyl]sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-[4-(2-chlorophenoxy)phenyl]sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-[4-(2-chlorophenoxy)phenyl]sulfonyl-4-ethyl-piperazin-4-ium Formula: C18H22ClN2O3S+ MolecularWeight: 381.89688

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3Cl

InChI

InChI=1S/C18H21ClN2O3S/c1-2-20-11-13-21(14-12-20)25(22,23)16-9-7-15(8-10-16)24-18-6-4-3-5-17(18)19/h3-10H,2,11-14H2,1H3/p+1