(E,3S,4R)-1-cyclohexyl-2,4-dimethyl-7-phenylmethoxy-hept-1-en-5-yn-3-ol

Systemtic Name: (E,3S,4R)-1-cyclohexyl-2,4-dimethyl-7-phenylmethoxy-hept-1-en-5-yn-3-ol Openeye Name: (E,3S,4R)-7-benzyloxy-1-cyclohexyl-2,4-dimethyl-hept-1-en-5-yn-3-ol CAS Name: (E,3S,4R)-1-cyclohexyl-2,4-dimethyl-7-phenylmethoxy-3-hept-1-en-5-ynol IUPAC Name: (E,3S,4R)-1-cyclohexyl-2,4-dimethyl-7-phenylmethoxyhept-1-en-5-yn-3-ol Traditional Name: (E,3S,4R)-7-benzoxy-1-cyclohexyl-2,4-dimethyl-hept-1-en-5-yn-3-ol Formula: C22H30O2 MolecularWeight: 326.4724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CCOCC1=CC=CC=C1)C(C(=CC2CCCCC2)C)O

Isomeric SMILES

C[C@H](C#CCOCC1=CC=CC=C1)[C@@H](/C(=C/C2CCCCC2)/C)O

InChI

InChI=1S/C22H30O2/c1-18(10-9-15-24-17-21-13-7-4-8-14-21)22(23)19(2)16-20-11-5-3-6-12-20/h4,7-8,13-14,16,18,20,22-23H,3,5-6,11-12,15,17H2,1-2H3/b19-16+/t18-,22+/m1/s1