4-[(2-chloranylethanoylamino)methyl]-2-nitro-phenolate

Systemtic Name: 4-[(2-chloranylethanoylamino)methyl]-2-nitro-phenolate Openeye Name: 4-[[(2-chloroacetyl)amino]methyl]-2-nitro-phenolate CAS Name: 4-[[(2-chloro-1-oxoethyl)amino]methyl]-2-nitrophenolate IUPAC Name: 4-[[(2-chloroacetyl)amino]methyl]-2-nitrophenolate Traditional Name: 4-[[(2-chloroacetyl)amino]methyl]-2-nitro-phenolate Formula: C9H8ClN2O4- MolecularWeight: 243.62382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC(=O)CCl)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC(=C(C=C1CNC(=O)CCl)[N+](=O)[O-])[O-]

InChI

InChI=1S/C9H9ClN2O4/c10-4-9(14)11-5-6-1-2-8(13)7(3-6)12(15)16/h1-3,13H,4-5H2,(H,11,14)/p-1