propan-2-yl 2-[4-[2,5-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanoate

Systemtic Name: propan-2-yl 2-[4-[2,5-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]ethanoate Openeye Name: isopropyl 2-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetate CAS Name: 2-[4-(2,5-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetate Traditional Name: 2-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetic acid isopropyl ester Formula: C15H21Cl2N2O4S+ MolecularWeight: 396.30924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20Cl2N2O4S/c1-11(2)23-15(20)10-18-5-7-19(8-6-18)24(21,22)14-9-12(16)3-4-13(14)17/h3-4,9,11H,5-8,10H2,1-2H3/p+1