(2S)-4-methyl-2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]pentanoate Openeye Name: (2S)-4-methyl-2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]pentanoate CAS Name: (2S)-4-methyl-2-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]pentanoate Traditional Name: (2S)-4-methyl-2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]valerate Formula: C11H14N3O5- MolecularWeight: 268.24596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C1=CC(=CN1)[N+](=O)[O-]

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)C1=CC(=CN1)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O5/c1-6(2)3-9(11(16)17)13-10(15)8-4-7(5-12-8)14(18)19/h4-6,9,12H,3H2,1-2H3,(H,13,15)(H,16,17)/p-1/t9-/m0/s1