2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]hexanoic acid Openeye Name: 2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]hexanoic acid CAS Name: 2-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]hexanoic acid Traditional Name: 2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]hexanoic acid Formula: C11H15N3O5 MolecularWeight: 269.2539

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O5/c1-2-3-4-8(11(16)17)13-10(15)9-5-7(6-12-9)14(18)19/h5-6,8,12H,2-4H2,1H3,(H,13,15)(H,16,17)