5-oxidanylidene-5-[4-[(2R)-2-oxidanyl-3-sulfonato-propyl]piperazin-4-ium-1-yl]pentanoate

Systemtic Name: 5-oxidanylidene-5-[4-[(2R)-2-oxidanyl-3-sulfonato-propyl]piperazin-4-ium-1-yl]pentanoate Openeye Name: 5-[4-[(2R)-2-hydroxy-3-sulfonato-propyl]piperazin-4-ium-1-yl]-5-oxo-pentanoate CAS Name: 5-[4-[(2R)-2-hydroxy-3-sulfonatopropyl]-1-piperazin-4-iumyl]-5-oxopentanoate IUPAC Name: 5-[4-[(2R)-2-hydroxy-3-sulfonatopropyl]piperazin-4-ium-1-yl]-5-oxopentanoate Traditional Name: 5-[4-[(2R)-2-hydroxy-3-sulfonato-propyl]piperazin-4-ium-1-yl]-5-keto-valerate Formula: C12H21N2O7S- MolecularWeight: 337.36934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(CS(=O)(=O)[O-])O)C(=O)CCCC(=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](CS(=O)(=O)[O-])O)C(=O)CCCC(=O)[O-]

InChI

InChI=1S/C12H22N2O7S/c15-10(9-22(19,20)21)8-13-4-6-14(7-5-13)11(16)2-1-3-12(17)18/h10,15H,1-9H2,(H,17,18)(H,19,20,21)/p-1/t10-/m1/s1