tert-butyl 2-[4-[2,3-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[4-[2,3-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanoate Openeye Name: tert-butyl 2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetate CAS Name: 2-[4-(2,3-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetate Traditional Name: 2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetic acid tert-butyl ester Formula: C16H23Cl2N2O4S+ MolecularWeight: 410.33582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22Cl2N2O4S/c1-16(2,3)24-14(21)11-19-7-9-20(10-8-19)25(22,23)13-6-4-5-12(17)15(13)18/h4-6H,7-11H2,1-3H3/p+1