4-[4-[2,5-bis(chloranyl)phenyl]sulfonylpiperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[2,5-bis(chloranyl)phenyl]sulfonylpiperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(2,5-dichlorophenyl)sulfonyl-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(2,5-dichlorophenyl)sulfonylpiperazino]-4-keto-butyric acid Formula: C14H16Cl2N2O5S MolecularWeight: 395.25824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)O)S(=O)(=O)C2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)O)S(=O)(=O)C2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C14H16Cl2N2O5S/c15-10-1-2-11(16)12(9-10)24(22,23)18-7-5-17(6-8-18)13(19)3-4-14(20)21/h1-2,9H,3-8H2,(H,20,21)