2-methyl-5-(3-nitrophenyl)-3-oxidanyl-pyran-4-one

Systemtic Name: 2-methyl-5-(3-nitrophenyl)-3-oxidanyl-pyran-4-one Openeye Name: 3-hydroxy-2-methyl-5-(3-nitrophenyl)pyran-4-one CAS Name: 3-hydroxy-2-methyl-5-(3-nitrophenyl)-4-pyranone IUPAC Name: 3-hydroxy-2-methyl-5-(3-nitrophenyl)pyran-4-one Traditional Name: 3-hydroxy-2-methyl-5-(3-nitrophenyl)pyran-4-one Formula: C12H9NO5 MolecularWeight: 247.20356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CO1)C2=CC(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C(=O)C(=CO1)C2=CC(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H9NO5/c1-7-11(14)12(15)10(6-18-7)8-3-2-4-9(5-8)13(16)17/h2-6,14H,1H3