(4-fluoranyl-4-methyl-cyclohexyl) 4-nitrobenzoate

Systemtic Name: (4-fluoranyl-4-methyl-cyclohexyl) 4-nitrobenzoate Openeye Name: (4-fluoro-4-methyl-cyclohexyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (4-fluoro-4-methylcyclohexyl) ester IUPAC Name: (4-fluoro-4-methylcyclohexyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4-fluoro-4-methyl-cyclohexyl) ester Formula: C14H16FNO4 MolecularWeight: 281.279543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

CC1(CCC(CC1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C14H16FNO4/c1-14(15)8-6-12(7-9-14)20-13(17)10-2-4-11(5-3-10)16(18)19/h2-5,12H,6-9H2,1H3