ethyl (1S,2S)-1-(2,4-dinitrophenyl)-2-oxidanyl-cyclopentane-1-carboxylate

Systemtic Name: ethyl (1S,2S)-1-(2,4-dinitrophenyl)-2-oxidanyl-cyclopentane-1-carboxylate Openeye Name: ethyl (1S,2S)-1-(2,4-dinitrophenyl)-2-hydroxy-cyclopentanecarboxylate CAS Name: (1S,2S)-1-(2,4-dinitrophenyl)-2-hydroxy-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S)-1-(2,4-dinitrophenyl)-2-hydroxycyclopentane-1-carboxylate Traditional Name: (1S,2S)-1-(2,4-dinitrophenyl)-2-hydroxy-cyclopentanecarboxylic acid ethyl ester Formula: C14H16N2O7 MolecularWeight: 324.28604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCC1O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@@]1(CCC[C@@H]1O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O7/c1-2-23-13(18)14(7-3-4-12(14)17)10-6-5-9(15(19)20)8-11(10)16(21)22/h5-6,8,12,17H,2-4,7H2,1H3/t12-,14-/m0/s1