3-[4-[2-(3-nitrophenyl)ethynyl]phenyl]-2-oxidanyl-2H-furan-5-one

Systemtic Name: 3-[4-[2-(3-nitrophenyl)ethynyl]phenyl]-2-oxidanyl-2H-furan-5-one Openeye Name: 2-hydroxy-3-[4-[2-(3-nitrophenyl)ethynyl]phenyl]-2H-furan-5-one CAS Name: 2-hydroxy-3-[4-[2-(3-nitrophenyl)ethynyl]phenyl]-2H-furan-5-one IUPAC Name: 2-hydroxy-3-[4-[2-(3-nitrophenyl)ethynyl]phenyl]-2H-furan-5-one Traditional Name: 2-hydroxy-3-[4-[2-(3-nitrophenyl)ethynyl]phenyl]-2H-furan-5-one Formula: C18H11NO5 MolecularWeight: 321.28364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C#CC2=CC=C(C=C2)C3=CC(=O)OC3O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C#CC2=CC=C(C=C2)C3=CC(=O)OC3O

InChI

InChI=1S/C18H11NO5/c20-17-11-16(18(21)24-17)14-8-6-12(7-9-14)4-5-13-2-1-3-15(10-13)19(22)23/h1-3,6-11,18,21H