[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (E)-4-bromanylbut-2-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (E)-4-bromanylbut-2-enoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (E)-4-bromobut-2-enoate CAS Name: (E)-4-bromo-2-butenoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (E)-4-bromobut-2-enoate Traditional Name: (E)-4-bromobut-2-enoic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C14H23BrO2 MolecularWeight: 303.23522

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C=CCBr)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)/C=C/CBr)C(C)C

InChI

InChI=1S/C14H23BrO2/c1-10(2)12-7-6-11(3)9-13(12)17-14(16)5-4-8-15/h4-5,10-13H,6-9H2,1-3H3/b5-4+/t11-,12+,13-/m1/s1