[(2S)-1-[(2R)-oxolan-2-yl]propan-2-yl] 3,5-dinitrobenzoate

Systemtic Name: [(2S)-1-[(2R)-oxolan-2-yl]propan-2-yl] 3,5-dinitrobenzoate Openeye Name: [(1S)-1-methyl-2-[(2R)-tetrahydrofuran-2-yl]ethyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [(2S)-1-[(2R)-2-oxolanyl]propan-2-yl] ester IUPAC Name: [(2S)-1-[(2R)-oxolan-2-yl]propan-2-yl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [(1S)-1-methyl-2-[(2R)-tetrahydrofuran-2-yl]ethyl] ester Formula: C14H16N2O7 MolecularWeight: 324.28604

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CCCO1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C[C@H]1CCCO1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O7/c1-9(5-13-3-2-4-22-13)23-14(17)10-6-11(15(18)19)8-12(7-10)16(20)21/h6-9,13H,2-5H2,1H3/t9-,13+/m0/s1