[(2S)-oxolan-2-yl]methyl 3,5-dinitrobenzoate

Systemtic Name: [(2S)-oxolan-2-yl]methyl 3,5-dinitrobenzoate Openeye Name: [(2S)-tetrahydrofuran-2-yl]methyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [(2S)-2-oxolanyl]methyl ester IUPAC Name: [(2S)-oxolan-2-yl]methyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [(2S)-tetrahydrofuran-2-yl]methyl ester Formula: C12H12N2O7 MolecularWeight: 296.23288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C[C@H](OC1)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O7/c15-12(21-7-11-2-1-3-20-11)8-4-9(13(16)17)6-10(5-8)14(18)19/h4-6,11H,1-3,7H2/t11-/m0/s1