(4S)-4-(2-azaniumylethanoylamino)-5-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: (4S)-4-(2-azaniumylethanoylamino)-5-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-5-oxidanylidene-pentanoate Openeye Name: (4S)-4-[(2-azaniumylacetyl)amino]-5-[(2-oxido-2-oxo-ethyl)amino]-5-oxo-pentanoate CAS Name: (4S)-4-[(2-ammonio-1-oxoethyl)amino]-5-[(2-oxido-2-oxoethyl)amino]-5-oxopentanoate IUPAC Name: (4S)-4-[(2-azaniumylacetyl)amino]-5-[(2-oxido-2-oxoethyl)amino]-5-oxopentanoate Traditional Name: (4S)-4-[(2-ammonioacetyl)amino]-5-keto-5-[(2-keto-2-oxido-ethyl)amino]valerate Formula: C9H14N3O6- MolecularWeight: 260.22396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15N3O6/c10-3-6(13)12-5(1-2-7(14)15)9(18)11-4-8(16)17/h5H,1-4,10H2,(H,11,18)(H,12,13)(H,14,15)(H,16,17)/p-1/t5-/m0/s1