(2R)-5-azanyl-2-[[(2S)-2-[(5-nitropyridin-2-yl)amino]propanoyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (2R)-5-azanyl-2-[[(2S)-2-[(5-nitropyridin-2-yl)amino]propanoyl]amino]-5-oxidanylidene-pentanoate Openeye Name: (2R)-5-amino-2-[[(2S)-2-[(5-nitro-2-pyridyl)amino]propanoyl]amino]-5-oxo-pentanoate CAS Name: (2R)-5-amino-2-[[(2S)-2-[(5-nitro-2-pyridinyl)amino]-1-oxopropyl]amino]-5-oxopentanoate IUPAC Name: (2R)-5-amino-2-[[(2S)-2-[(5-nitropyridin-2-yl)amino]propanoyl]amino]-5-oxopentanoate Traditional Name: (2R)-5-amino-5-keto-2-[[(2S)-2-[(5-nitro-2-pyridyl)amino]propanoyl]amino]valerate Formula: C13H16N5O6- MolecularWeight: 338.29604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC(=O)N)C(=O)[O-])NC1=NC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N[C@H](CCC(=O)N)C(=O)[O-])NC1=NC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H17N5O6/c1-7(16-11-5-2-8(6-15-11)18(23)24)12(20)17-9(13(21)22)3-4-10(14)19/h2,5-7,9H,3-4H2,1H3,(H2,14,19)(H,15,16)(H,17,20)(H,21,22)/p-1/t7-,9+/m0/s1