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

Systemtic Name: (2S)-2-azaniumyl-5-[[(2S)-3-(1H-imidazol-5-yl)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-2-azaniumyl-5-[[(1S)-1-(1H-imidazol-5-ylmethyl)-2-oxido-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: (2S)-2-ammonio-5-[[(2S)-3-(1H-imidazol-5-yl)-1-oxido-1-oxopropan-2-yl]amino]-5-oxopentanoate IUPAC Name: (2S)-2-azaniumyl-5-[[(2S)-3-(1H-imidazol-5-yl)-1-oxido-1-oxopropan-2-yl]amino]-5-oxopentanoate Traditional Name: (2S)-2-ammonio-5-[[(1S)-1-(1H-imidazol-5-ylmethyl)-2-keto-2-oxido-ethyl]amino]-5-keto-valerate Formula: C11H15N4O5- MolecularWeight: 283.2606

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)[O-])NC(=O)CCC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=C(NC=N1)C[C@@H](C(=O)[O-])NC(=O)CC[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C11H16N4O5/c12-7(10(17)18)1-2-9(16)15-8(11(19)20)3-6-4-13-5-14-6/h4-5,7-8H,1-3,12H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)/p-1/t7-,8-/m0/s1