[(2S,3R)-4,4-bis(chloranyl)-2-methyl-5-oxidanylidene-oxolan-3-yl] 4-nitrobenzoate

Systemtic Name: [(2S,3R)-4,4-bis(chloranyl)-2-methyl-5-oxidanylidene-oxolan-3-yl] 4-nitrobenzoate Openeye Name: [(2S,3R)-4,4-dichloro-2-methyl-5-oxo-tetrahydrofuran-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,3R)-4,4-dichloro-2-methyl-5-oxo-3-oxolanyl] ester IUPAC Name: [(2S,3R)-4,4-dichloro-2-methyl-5-oxooxolan-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2S,3R)-4,4-dichloro-5-keto-2-methyl-tetrahydrofuran-3-yl] ester Formula: C12H9Cl2NO6 MolecularWeight: 334.10896

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=O)O1)(Cl)Cl)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1[C@H](C(C(=O)O1)(Cl)Cl)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H9Cl2NO6/c1-6-9(12(13,14)11(17)20-6)21-10(16)7-2-4-8(5-3-7)15(18)19/h2-6,9H,1H3/t6-,9+/m0/s1