1-methoxy-4-[[(4S,5R)-4-methylhexadec-2-yn-5-yl]oxymethyl]benzene

Systemtic Name: 1-methoxy-4-[[(4S,5R)-4-methylhexadec-2-yn-5-yl]oxymethyl]benzene Openeye Name: 1-methoxy-4-[[(1R)-1-[(1S)-1-methylbut-2-ynyl]dodecoxy]methyl]benzene CAS Name: 1-methoxy-4-[[(4S,5R)-4-methylhexadec-2-yn-5-yl]oxymethyl]benzene IUPAC Name: 1-methoxy-4-[[(4S,5R)-4-methylhexadec-2-yn-5-yl]oxymethyl]benzene Traditional Name: 1-methoxy-4-[[(1R,2S)-2-methyl-1-undecyl-pent-3-ynoxy]methyl]benzene Formula: C25H40O2 MolecularWeight: 372.5839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(C)C#CC)OCC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCCCCCCC[C@H]([C@@H](C)C#CC)OCC1=CC=C(C=C1)OC

InChI

InChI=1S/C25H40O2/c1-5-7-8-9-10-11-12-13-14-16-25(22(3)15-6-2)27-21-23-17-19-24(26-4)20-18-23/h17-20,22,25H,5,7-14,16,21H2,1-4H3/t22-,25+/m0/s1