(1R,6R)-6-(4-fluorophenyl)-1-methoxycarbonyl-4-methyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-(4-fluorophenyl)-1-methoxycarbonyl-4-methyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-(4-fluorophenyl)-1-methoxycarbonyl-4-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-(4-fluorophenyl)-1-methoxycarbonyl-4-methyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-(4-fluorophenyl)-1-methoxycarbonyl-4-methylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-1-carbomethoxy-6-(4-fluorophenyl)-4-methyl-cyclohex-3-ene-1-carboxylate Formula: C16H16FO4- MolecularWeight: 291.294243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)C2=CC=C(C=C2)F)(C(=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC[C@@]([C@H](C1)C2=CC=C(C=C2)F)(C(=O)[O-])C(=O)OC

InChI

InChI=1S/C16H17FO4/c1-10-7-8-16(14(18)19,15(20)21-2)13(9-10)11-3-5-12(17)6-4-11/h3-7,13H,8-9H2,1-2H3,(H,18,19)/p-1/t13-,16-/m1/s1