6-(8-bromanyloct-1-ynyl)-2,3-bis(oxan-2-yl)phenol

Systemtic Name: 6-(8-bromanyloct-1-ynyl)-2,3-bis(oxan-2-yl)phenol Openeye Name: 6-(8-bromooct-1-ynyl)-2,3-di(tetrahydropyran-2-yl)phenol CAS Name: 6-(8-bromooct-1-ynyl)-2,3-bis(2-oxanyl)phenol IUPAC Name: 6-(8-bromooct-1-ynyl)-2,3-bis(oxan-2-yl)phenol Traditional Name: 6-(8-bromooct-1-ynyl)-2,3-di(tetrahydropyran-2-yl)phenol Formula: C24H33BrO3 MolecularWeight: 449.42102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C2=C(C(=C(C=C2)C#CCCCCCCBr)O)C3CCCCO3

Isomeric SMILES

C1CCOC(C1)C2=C(C(=C(C=C2)C#CCCCCCCBr)O)C3CCCCO3

InChI

InChI=1S/C24H33BrO3/c25-16-8-4-2-1-3-5-11-19-14-15-20(21-12-6-9-17-27-21)23(24(19)26)22-13-7-10-18-28-22/h14-15,21-22,26H,1-4,6-10,12-13,16-18H2