[(2S,3S)-2-methoxy-4,4-dimethyl-oxolan-3-yl] 4-nitrobenzoate

Systemtic Name: [(2S,3S)-2-methoxy-4,4-dimethyl-oxolan-3-yl] 4-nitrobenzoate Openeye Name: [(2S,3S)-2-methoxy-4,4-dimethyl-tetrahydrofuran-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,3S)-2-methoxy-4,4-dimethyl-3-oxolanyl] ester IUPAC Name: [(2S,3S)-2-methoxy-4,4-dimethyloxolan-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2S,3S)-2-methoxy-4,4-dimethyl-tetrahydrofuran-3-yl] ester Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(C1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1(CO[C@@H]([C@H]1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC)C

InChI

InChI=1S/C14H17NO6/c1-14(2)8-20-13(19-3)11(14)21-12(16)9-4-6-10(7-5-9)15(17)18/h4-7,11,13H,8H2,1-3H3/t11-,13+/m1/s1