4-oxidanylidene-4-[4-(2-oxidanyl-3-sulfo-propyl)piperazin-1-yl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[4-(2-oxidanyl-3-sulfo-propyl)piperazin-1-yl]butanoic acid Openeye Name: 4-[4-(2-hydroxy-3-sulfo-propyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(2-hydroxy-3-sulfopropyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(2-hydroxy-3-sulfopropyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(2-hydroxy-3-sulfo-propyl)piperazino]-4-keto-butyric acid Formula: C11H20N2O7S MolecularWeight: 324.3507

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CS(=O)(=O)O)O)C(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1CC(CS(=O)(=O)O)O)C(=O)CCC(=O)O

InChI

InChI=1S/C11H20N2O7S/c14-9(8-21(18,19)20)7-12-3-5-13(6-4-12)10(15)1-2-11(16)17/h9,14H,1-8H2,(H,16,17)(H,18,19,20)