ethyl 2-[3-oxidanylidene-1-[2,4,5-tris(chloranyl)phenyl]sulfonyl-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[3-oxidanylidene-1-[2,4,5-tris(chloranyl)phenyl]sulfonyl-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[3-oxo-1-(2,4,5-trichlorophenyl)sulfonyl-piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-(2,4,5-trichlorophenyl)sulfonyl-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-oxo-1-(2,4,5-trichlorophenyl)sulfonylpiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(2,4,5-trichlorophenyl)sulfonyl-piperazin-2-yl]acetic acid ethyl ester Formula: C14H15Cl3N2O5S MolecularWeight: 429.7033

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCOC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C14H15Cl3N2O5S/c1-2-24-13(20)7-11-14(21)18-3-4-19(11)25(22,23)12-6-9(16)8(15)5-10(12)17/h5-6,11H,2-4,7H2,1H3,(H,18,21)