tert-butyl (1R)-1-[(1S)-1-(4-fluorophenyl)-2-nitro-ethyl]-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: tert-butyl (1R)-1-[(1S)-1-(4-fluorophenyl)-2-nitro-ethyl]-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: tert-butyl (1R)-1-[(1S)-1-(4-fluorophenyl)-2-nitro-ethyl]-2-oxo-cyclopentanecarboxylate CAS Name: (1R)-1-[(1S)-1-(4-fluorophenyl)-2-nitroethyl]-2-oxo-1-cyclopentanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R)-1-[(1S)-1-(4-fluorophenyl)-2-nitroethyl]-2-oxocyclopentane-1-carboxylate Traditional Name: (1R)-1-[(1S)-1-(4-fluorophenyl)-2-nitro-ethyl]-2-keto-cyclopentanecarboxylic acid tert-butyl ester Formula: C18H22FNO5 MolecularWeight: 351.369383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCCC1=O)C(C[N+](=O)[O-])C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)[C@]1(CCCC1=O)[C@@H](C[N+](=O)[O-])C2=CC=C(C=C2)F

InChI

InChI=1S/C18H22FNO5/c1-17(2,3)25-16(22)18(10-4-5-15(18)21)14(11-20(23)24)12-6-8-13(19)9-7-12/h6-9,14H,4-5,10-11H2,1-3H3/t14-,18+/m0/s1