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

Systemtic Name: tert-butyl (1R)-1-[(1S)-2-nitro-1-phenyl-ethyl]-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: tert-butyl (1R)-1-[(1S)-2-nitro-1-phenyl-ethyl]-2-oxo-cyclopentanecarboxylate CAS Name: (1R)-1-[(1S)-2-nitro-1-phenylethyl]-2-oxo-1-cyclopentanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R)-1-[(1S)-2-nitro-1-phenylethyl]-2-oxocyclopentane-1-carboxylate Traditional Name: (1R)-2-keto-1-[(1S)-2-nitro-1-phenyl-ethyl]cyclopentanecarboxylic acid tert-butyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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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=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO5/c1-17(2,3)24-16(21)18(11-7-10-15(18)20)14(12-19(22)23)13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12H2,1-3H3/t14-,18+/m0/s1