1-[(2S,4S)-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-5-methyl-hex-4-en-2-yn-1-ol

Systemtic Name: 1-[(2S,4S)-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-5-methyl-hex-4-en-2-yn-1-ol Openeye Name: 1-[(2S,4S)-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-5-methyl-hex-4-en-2-yn-1-ol CAS Name: 1-[(2S,4S)-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-5-methyl-1-hex-4-en-2-ynol IUPAC Name: 1-[(2S,4S)-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-5-methylhex-4-en-2-yn-1-ol Traditional Name: 1-[(2S,4S)-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-5-methyl-hex-4-en-2-yn-1-ol Formula: C18H22O4 MolecularWeight: 302.36488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#CC(C1CCOC(O1)C2=CC=C(C=C2)OC)O)C

Isomeric SMILES

CC(=CC#CC([C@@H]1CCO[C@@H](O1)C2=CC=C(C=C2)OC)O)C

InChI

InChI=1S/C18H22O4/c1-13(2)5-4-6-16(19)17-11-12-21-18(22-17)14-7-9-15(20-3)10-8-14/h5,7-10,16-19H,11-12H2,1-3H3/t16?,17-,18-/m0/s1