(4-ethanoylphenyl) 4-nitro-1H-pyrrole-2-carboxylate

Systemtic Name: (4-ethanoylphenyl) 4-nitro-1H-pyrrole-2-carboxylate Openeye Name: (4-acetylphenyl) 4-nitro-1H-pyrrole-2-carboxylate CAS Name: 4-nitro-1H-pyrrole-2-carboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-nitro-1H-pyrrole-2-carboxylate Traditional Name: 4-nitro-1H-pyrrole-2-carboxylic acid (4-acetylphenyl) ester Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CN2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CN2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O5/c1-8(16)9-2-4-11(5-3-9)20-13(17)12-6-10(7-14-12)15(18)19/h2-7,14H,1H3