(2S)-2-[(1-methyl-5-nitro-pyrrol-2-yl)carbonylamino]propanoate

Systemtic Name: (2S)-2-[(1-methyl-5-nitro-pyrrol-2-yl)carbonylamino]propanoate Openeye Name: (2S)-2-[(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]propanoate CAS Name: (2S)-2-[[(1-methyl-5-nitro-2-pyrrolyl)-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[(1-methyl-5-nitropyrrole-2-carbonyl)amino]propanoate Traditional Name: (2S)-2-[(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]propionate Formula: C9H10N3O5- MolecularWeight: 240.1928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)C1=CC=C(N1C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)C1=CC=C(N1C)[N+](=O)[O-]

InChI

InChI=1S/C9H11N3O5/c1-5(9(14)15)10-8(13)6-3-4-7(11(6)2)12(16)17/h3-5H,1-2H3,(H,10,13)(H,14,15)/p-1/t5-/m0/s1