(2R,3S)-3-[2-(4-fluorophenyl)ethynyl]-3,7-dimethyl-1-phenylmethoxy-oct-6-en-2-ol

Systemtic Name: (2R,3S)-3-[2-(4-fluorophenyl)ethynyl]-3,7-dimethyl-1-phenylmethoxy-oct-6-en-2-ol Openeye Name: (2R,3S)-1-benzyloxy-3-[2-(4-fluorophenyl)ethynyl]-3,7-dimethyl-oct-6-en-2-ol CAS Name: (2R,3S)-3-[2-(4-fluorophenyl)ethynyl]-3,7-dimethyl-1-phenylmethoxy-6-octen-2-ol IUPAC Name: (2R,3S)-3-[2-(4-fluorophenyl)ethynyl]-3,7-dimethyl-1-phenylmethoxyoct-6-en-2-ol Traditional Name: (2R,3S)-1-benzoxy-3-[2-(4-fluorophenyl)ethynyl]-3,7-dimethyl-oct-6-en-2-ol Formula: C25H29FO2 MolecularWeight: 380.494963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C#CC1=CC=C(C=C1)F)C(COCC2=CC=CC=C2)O)C

Isomeric SMILES

CC(=CCC[C@@](C)(C#CC1=CC=C(C=C1)F)[C@H](COCC2=CC=CC=C2)O)C

InChI

InChI=1S/C25H29FO2/c1-20(2)8-7-16-25(3,17-15-21-11-13-23(26)14-12-21)24(27)19-28-18-22-9-5-4-6-10-22/h4-6,8-14,24,27H,7,16,18-19H2,1-3H3/t24-,25-/m0/s1