(E)-8,8-dimethyl-2-[5-(3-thiophen-3-ylphenoxy)pentyl]non-4-en-6-yn-1-ol

Systemtic Name: (E)-8,8-dimethyl-2-[5-(3-thiophen-3-ylphenoxy)pentyl]non-4-en-6-yn-1-ol Openeye Name: (E)-8,8-dimethyl-2-[5-[3-(3-thienyl)phenoxy]pentyl]non-4-en-6-yn-1-ol CAS Name: (E)-8,8-dimethyl-2-[5-[3-(3-thiophenyl)phenoxy]pentyl]-1-non-4-en-6-ynol IUPAC Name: (E)-8,8-dimethyl-2-[5-(3-thiophen-3-ylphenoxy)pentyl]non-4-en-6-yn-1-ol Traditional Name: (E)-8,8-dimethyl-2-[5-[3-(3-thienyl)phenoxy]pentyl]non-4-en-6-yn-1-ol Formula: C26H34O2S MolecularWeight: 410.61196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCC(CCCCCOC1=CC=CC(=C1)C2=CSC=C2)CO

Isomeric SMILES

CC(C)(C)C#C/C=C/CC(CCCCCOC1=CC=CC(=C1)C2=CSC=C2)CO

InChI

InChI=1S/C26H34O2S/c1-26(2,3)16-8-4-6-11-22(20-27)12-7-5-9-17-28-25-14-10-13-23(19-25)24-15-18-29-21-24/h4,6,10,13-15,18-19,21-22,27H,5,7,9,11-12,17,20H2,1-3H3/b6-4+