2-azaniumyl-5-[(1-oxidanidyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 2-azaniumyl-5-[(1-oxidanidyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: 2-azaniumyl-5-[[2-oxido-2-oxo-1-(sulfanylmethyl)ethyl]amino]-5-oxo-pentanoate CAS Name: 2-ammonio-5-[(3-mercapto-1-oxido-1-oxopropan-2-yl)amino]-5-oxopentanoate IUPAC Name: 2-azaniumyl-5-[(1-oxido-1-oxo-3-sulfanylpropan-2-yl)amino]-5-oxopentanoate Traditional Name: 2-ammonio-5-keto-5-[[2-keto-1-(mercaptomethyl)-2-oxido-ethyl]amino]valerate Formula: C8H13N2O5S- MolecularWeight: 249.26422

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)NC(CS)C(=O)[O-])C(C(=O)[O-])[NH3+]

Isomeric SMILES

C(CC(=O)NC(CS)C(=O)[O-])C(C(=O)[O-])[NH3+]

InChI

InChI=1S/C8H14N2O5S/c9-4(7(12)13)1-2-6(11)10-5(3-16)8(14)15/h4-5,16H,1-3,9H2,(H,10,11)(H,12,13)(H,14,15)/p-1