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

Systemtic Name: 6-methyl-4-[2-(4-nitrophenyl)ethynyl]pyran-2-one Openeye Name: 6-methyl-4-[2-(4-nitrophenyl)ethynyl]pyran-2-one CAS Name: 6-methyl-4-[2-(4-nitrophenyl)ethynyl]-2-pyranone IUPAC Name: 6-methyl-4-[2-(4-nitrophenyl)ethynyl]pyran-2-one Traditional Name: 6-methyl-4-[2-(4-nitrophenyl)ethynyl]pyran-2-one Formula: C14H9NO4 MolecularWeight: 255.22556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=O)O1)C#CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=O)O1)C#CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H9NO4/c1-10-8-12(9-14(16)19-10)3-2-11-4-6-13(7-5-11)15(17)18/h4-9H,1H3