2-[(4-nitro-1-propan-2-yl-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(4-nitro-1-propan-2-yl-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(1-isopropyl-4-nitro-pyrrole-2-carbonyl)amino]propanoic acid CAS Name: 3-hydroxy-2-[[(4-nitro-1-propan-2-yl-2-pyrrolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[(4-nitro-1-propan-2-ylpyrrole-2-carbonyl)amino]propanoic acid Traditional Name: 3-hydroxy-2-[(1-isopropyl-4-nitro-pyrrole-2-carbonyl)amino]propionic acid Formula: C11H15N3O6 MolecularWeight: 285.2533

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)NC(CO)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)NC(CO)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O6/c1-6(2)13-4-7(14(19)20)3-9(13)10(16)12-8(5-15)11(17)18/h3-4,6,8,15H,5H2,1-2H3,(H,12,16)(H,17,18)