3-oxidanylidene-3-[4-(2-sulfonatoethyl)piperazin-4-ium-1-yl]propanoate

Systemtic Name: 3-oxidanylidene-3-[4-(2-sulfonatoethyl)piperazin-4-ium-1-yl]propanoate Openeye Name: 3-oxo-3-[4-(2-sulfonatoethyl)piperazin-4-ium-1-yl]propanoate CAS Name: 3-oxo-3-[4-(2-sulfonatoethyl)-1-piperazin-4-iumyl]propanoate IUPAC Name: 3-oxo-3-[4-(2-sulfonatoethyl)piperazin-4-ium-1-yl]propanoate Traditional Name: 3-keto-3-[4-(2-sulfonatoethyl)piperazin-4-ium-1-yl]propionate Formula: C9H15N2O6S- MolecularWeight: 279.2902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16N2O6S/c12-8(7-9(13)14)11-3-1-10(2-4-11)5-6-18(15,16)17/h1-7H2,(H,13,14)(H,15,16,17)/p-1