(4S)-4-(2-azaniumylethanoylamino)-5-[[(2S)-3-cyano-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (4S)-4-(2-azaniumylethanoylamino)-5-[[(2S)-3-cyano-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: (4S)-4-[(2-azaniumylacetyl)amino]-5-[[(1S)-1-(cyanomethyl)-2-oxido-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: (4S)-4-[(2-ammonio-1-oxoethyl)amino]-5-[[(2S)-3-cyano-1-oxido-1-oxopropan-2-yl]amino]-5-oxopentanoate IUPAC Name: (4S)-4-[(2-azaniumylacetyl)amino]-5-[[(2S)-3-cyano-1-oxido-1-oxopropan-2-yl]amino]-5-oxopentanoate Traditional Name: (4S)-4-[(2-ammonioacetyl)amino]-5-[[(1S)-1-(cyanomethyl)-2-keto-2-oxido-ethyl]amino]-5-keto-valerate Formula: C11H15N4O6- MolecularWeight: 299.26

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4O6/c12-4-3-7(11(20)21)15-10(19)6(1-2-9(17)18)14-8(16)5-13/h6-7H,1-3,5,13H2,(H,14,16)(H,15,19)(H,17,18)(H,20,21)/p-1/t6-,7-/m0/s1