[(1R,2S)-2-(4-phenoxyphenyl)cyclohexyl] (E)-but-2-enoate

Systemtic Name: [(1R,2S)-2-(4-phenoxyphenyl)cyclohexyl] (E)-but-2-enoate Openeye Name: [(1R,2S)-2-(4-phenoxyphenyl)cyclohexyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [(1R,2S)-2-(4-phenoxyphenyl)cyclohexyl] ester IUPAC Name: [(1R,2S)-2-(4-phenoxyphenyl)cyclohexyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [(1R,2S)-2-(4-phenoxyphenyl)cyclohexyl] ester Formula: C22H24O3 MolecularWeight: 336.42416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OC1CCCCC1C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C/C=C/C(=O)O[C@@H]1CCCC[C@H]1C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H24O3/c1-2-8-22(23)25-21-12-7-6-11-20(21)17-13-15-19(16-14-17)24-18-9-4-3-5-10-18/h2-5,8-10,13-16,20-21H,6-7,11-12H2,1H3/b8-2+/t20-,21+/m0/s1