4-(4-nitrophenyl)carbonyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-(4-nitrophenyl)carbonyl-1H-pyrrole-3-carboxylic acid Openeye Name: 4-(4-nitrobenzoyl)-1H-pyrrole-3-carboxylic acid CAS Name: 4-[(4-nitrophenyl)-oxomethyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-(4-nitrobenzoyl)-1H-pyrrole-3-carboxylic acid Traditional Name: 4-(4-nitrobenzoyl)-1H-pyrrole-3-carboxylic acid Formula: C12H8N2O5 MolecularWeight: 260.20232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CNC=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CNC=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O5/c15-11(9-5-13-6-10(9)12(16)17)7-1-3-8(4-2-7)14(18)19/h1-6,13H,(H,16,17)