4-(4-nitrophenyl)carbonyl-1H-pyrrole-2-carbaldehyde

Systemtic Name: 4-(4-nitrophenyl)carbonyl-1H-pyrrole-2-carbaldehyde Openeye Name: 4-(4-nitrobenzoyl)-1H-pyrrole-2-carbaldehyde CAS Name: 4-[(4-nitrophenyl)-oxomethyl]-1H-pyrrole-2-carboxaldehyde IUPAC Name: 4-(4-nitrobenzoyl)-1H-pyrrole-2-carbaldehyde Traditional Name: 4-(4-nitrobenzoyl)-1H-pyrrole-2-carbaldehyde Formula: C12H8N2O4 MolecularWeight: 244.20292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N2O4/c15-7-10-5-9(6-13-10)12(16)8-1-3-11(4-2-8)14(17)18/h1-7,13H