4-chloranyl-6-[2-(4-nitrophenyl)ethynyl]pyran-2-one

Systemtic Name: 4-chloranyl-6-[2-(4-nitrophenyl)ethynyl]pyran-2-one Openeye Name: 4-chloro-6-[2-(4-nitrophenyl)ethynyl]pyran-2-one CAS Name: 4-chloro-6-[2-(4-nitrophenyl)ethynyl]-2-pyranone IUPAC Name: 4-chloro-6-[2-(4-nitrophenyl)ethynyl]pyran-2-one Traditional Name: 4-chloro-6-[2-(4-nitrophenyl)ethynyl]pyran-2-one Formula: C13H6ClNO4 MolecularWeight: 275.64404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CC(=CC(=O)O2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CC(=CC(=O)O2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H6ClNO4/c14-10-7-12(19-13(16)8-10)6-3-9-1-4-11(5-2-9)15(17)18/h1-2,4-5,7-8H