ethyl (1S)-1-[(4-nitrophenyl)methyl]-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: ethyl (1S)-1-[(4-nitrophenyl)methyl]-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: ethyl (1S)-1-[(4-nitrophenyl)methyl]-2-oxo-cyclohexanecarboxylate CAS Name: (1S)-1-[(4-nitrophenyl)methyl]-2-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S)-1-[(4-nitrophenyl)methyl]-2-oxocyclohexane-1-carboxylate Traditional Name: (1S)-2-keto-1-(4-nitrobenzyl)cyclohexanecarboxylic acid ethyl ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCCC1=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@@]1(CCCCC1=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19NO5/c1-2-22-15(19)16(10-4-3-5-14(16)18)11-12-6-8-13(9-7-12)17(20)21/h6-9H,2-5,10-11H2,1H3/t16-/m0/s1