3-bromanyl-3-[bromanyl-(6-nitro-1,3-benzodioxol-5-yl)methyl]-5-methyl-oxolan-2-one

Systemtic Name: 3-bromanyl-3-[bromanyl-(6-nitro-1,3-benzodioxol-5-yl)methyl]-5-methyl-oxolan-2-one Openeye Name: 3-bromo-3-[bromo-(6-nitro-1,3-benzodioxol-5-yl)methyl]-5-methyl-tetrahydrofuran-2-one CAS Name: 3-bromo-3-[bromo-(6-nitro-1,3-benzodioxol-5-yl)methyl]-5-methyl-2-oxolanone IUPAC Name: 3-bromo-3-[bromo-(6-nitro-1,3-benzodioxol-5-yl)methyl]-5-methyloxolan-2-one Traditional Name: 3-bromo-3-[bromo-(6-nitro-1,3-benzodioxol-5-yl)methyl]-5-methyl-tetrahydrofuran-2-one Formula: C13H11Br2NO6 MolecularWeight: 437.03754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)(C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)Br)Br

Isomeric SMILES

CC1CC(C(=O)O1)(C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)Br)Br

InChI

InChI=1S/C13H11Br2NO6/c1-6-4-13(15,12(17)22-6)11(14)7-2-9-10(21-5-20-9)3-8(7)16(18)19/h2-3,6,11H,4-5H2,1H3