[(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] (E)-3-phenylprop-2-enoate Openeye Name: [(1R,2S,5R)-5-methyl-2-[1-methyl-1-(2-naphthyl)ethyl]cyclohexyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [(1R,2S,5R)-5-methyl-2-[2-(2-naphthalenyl)propan-2-yl]cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [(1R,2S,5R)-5-methyl-2-[1-methyl-1-(2-naphthyl)ethyl]cyclohexyl] ester Formula: C29H32O2 MolecularWeight: 412.56318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C=CC2=CC=CC=C2)C(C)(C)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)/C=C/C2=CC=CC=C2)C(C)(C)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H32O2/c1-21-13-17-26(27(19-21)31-28(30)18-14-22-9-5-4-6-10-22)29(2,3)25-16-15-23-11-7-8-12-24(23)20-25/h4-12,14-16,18,20-21,26-27H,13,17,19H2,1-3H3/b18-14+/t21-,26-,27-/m1/s1