(4-nitrophenyl)methyl 3-(1-ethanoyl-2-oxidanylidene-cyclohexyl)propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-(1-ethanoyl-2-oxidanylidene-cyclohexyl)propanoate Openeye Name: (4-nitrophenyl)methyl 3-(1-acetyl-2-oxo-cyclohexyl)propanoate CAS Name: 3-(1-acetyl-2-oxocyclohexyl)propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(1-acetyl-2-oxocyclohexyl)propanoate Traditional Name: 3-(1-acetyl-2-keto-cyclohexyl)propionic acid (4-nitrobenzyl) ester Formula: C18H21NO6 MolecularWeight: 347.36244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCCCC1=O)CCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1(CCCCC1=O)CCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21NO6/c1-13(20)18(10-3-2-4-16(18)21)11-9-17(22)25-12-14-5-7-15(8-6-14)19(23)24/h5-8H,2-4,9-12H2,1H3