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3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]oxan-2-one

3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]oxan-2-one

Systemtic Name:3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]oxan-2-one
Openeye Name:3-[(6-nitro-1,3-benzodioxol-5-yl)methylene]tetrahydropyran-2-one
CAS Name:3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-oxanone
IUPAC Name:3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]oxan-2-one
Traditional Name:3-[(6-nitro-1,3-benzodioxol-5-yl)methylene]tetrahydropyran-2-one
Formula: C13H11NO6
MolecularWeight: 277.22954
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)OC1


Isomeric SMILES

C1CC(=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)OC1


InChI

InChI=1S/C13H11NO6/c15-13-8(2-1-3-18-13)4-9-5-11-12(20-7-19-11)6-10(9)14(16)17/h4-6H,1-3,7H2


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