(4-nitrophenyl) [(1S,2S)-2-(2-oxidanylideneethyl)cyclohexyl]methyl carbonate

Systemtic Name: (4-nitrophenyl) [(1S,2S)-2-(2-oxidanylideneethyl)cyclohexyl]methyl carbonate Openeye Name: (4-nitrophenyl) [(1S,2S)-2-(2-oxoethyl)cyclohexyl]methyl carbonate CAS Name: carbonic acid (4-nitrophenyl) [(1S,2S)-2-(2-oxoethyl)cyclohexyl]methyl ester IUPAC Name: (4-nitrophenyl) [(1S,2S)-2-(2-oxoethyl)cyclohexyl]methyl carbonate Traditional Name: carbonic acid [(1S,2S)-2-(2-ketoethyl)cyclohexyl]methyl (4-nitrophenyl) ester Formula: C16H19NO6 MolecularWeight: 321.32516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC=O)COC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)CC=O)COC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19NO6/c18-10-9-12-3-1-2-4-13(12)11-22-16(19)23-15-7-5-14(6-8-15)17(20)21/h5-8,10,12-13H,1-4,9,11H2/t12-,13+/m0/s1