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(5-methyl-2-oxidanylidene-oxolan-3-yl) 4-methyl-3-nitro-benzoate

(5-methyl-2-oxidanylidene-oxolan-3-yl) 4-methyl-3-nitro-benzoate

Systemtic Name:(5-methyl-2-oxidanylidene-oxolan-3-yl) 4-methyl-3-nitro-benzoate
Openeye Name:(5-methyl-2-oxo-tetrahydrofuran-3-yl) 4-methyl-3-nitro-benzoate
CAS Name:4-methyl-3-nitrobenzoic acid (5-methyl-2-oxo-3-oxolanyl) ester
IUPAC Name:(5-methyl-2-oxooxolan-3-yl) 4-methyl-3-nitrobenzoate
Traditional Name:4-methyl-3-nitro-benzoic acid (2-keto-5-methyl-tetrahydrofuran-3-yl) ester
Formula: C13H13NO6
MolecularWeight: 279.24542
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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)OC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]


Isomeric SMILES

CC1CC(C(=O)O1)OC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]


InChI

InChI=1S/C13H13NO6/c1-7-3-4-9(6-10(7)14(17)18)12(15)20-11-5-8(2)19-13(11)16/h3-4,6,8,11H,5H2,1-2H3


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