(3S)-3-(2-azaniumylethanoylamino)-4-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (3S)-3-(2-azaniumylethanoylamino)-4-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-butanoate Openeye Name: (3S)-3-[(2-azaniumylacetyl)amino]-4-[(2-oxido-2-oxo-ethyl)amino]-4-oxo-butanoate CAS Name: (3S)-3-[(2-ammonio-1-oxoethyl)amino]-4-[(2-oxido-2-oxoethyl)amino]-4-oxobutanoate IUPAC Name: (3S)-3-[(2-azaniumylacetyl)amino]-4-[(2-oxido-2-oxoethyl)amino]-4-oxobutanoate Traditional Name: (3S)-3-[(2-ammonioacetyl)amino]-4-keto-4-[(2-keto-2-oxido-ethyl)amino]butyrate Formula: C8H12N3O6- MolecularWeight: 246.19738

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)NCC(=O)[O-])NC(=O)C[NH3+])C(=O)[O-]

Isomeric SMILES

C([C@@H](C(=O)NCC(=O)[O-])NC(=O)C[NH3+])C(=O)[O-]

InChI

InChI=1S/C8H13N3O6/c9-2-5(12)11-4(1-6(13)14)8(17)10-3-7(15)16/h4H,1-3,9H2,(H,10,17)(H,11,12)(H,13,14)(H,15,16)/p-1/t4-/m0/s1