4,4-dimethyl-7-nitro-6-oxidanyl-3H-chromen-2-one

Systemtic Name: 4,4-dimethyl-7-nitro-6-oxidanyl-3H-chromen-2-one Openeye Name: 6-hydroxy-4,4-dimethyl-7-nitro-chroman-2-one CAS Name: 6-hydroxy-4,4-dimethyl-7-nitro-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 6-hydroxy-4,4-dimethyl-7-nitro-3H-chromen-2-one Traditional Name: 6-hydroxy-4,4-dimethyl-7-nitro-chroman-2-one Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)OC2=CC(=C(C=C21)O)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=O)OC2=CC(=C(C=C21)O)[N+](=O)[O-])C

InChI

InChI=1S/C11H11NO5/c1-11(2)5-10(14)17-9-4-7(12(15)16)8(13)3-6(9)11/h3-4,13H,5H2,1-2H3