methyl (Z)-11-[2-[(1R,2S)-2-phenylcyclohexyl]oxypropan-2-ylperoxy]octadec-9-enoate

Systemtic Name: methyl (Z)-11-[2-[(1R,2S)-2-phenylcyclohexyl]oxypropan-2-ylperoxy]octadec-9-enoate Openeye Name: methyl (Z)-11-[1-methyl-1-[(1R,2S)-2-phenylcyclohexoxy]ethyl]peroxyoctadec-9-enoate CAS Name: (Z)-11-[2-[(1R,2S)-2-phenylcyclohexyl]oxypropan-2-yldioxy]-9-octadecenoic acid methyl ester IUPAC Name: methyl (Z)-11-[2-[(1R,2S)-2-phenylcyclohexyl]oxypropan-2-ylperoxy]octadec-9-enoate Traditional Name: (Z)-11-[1-methyl-1-[(1R,2S)-2-phenylcyclohexoxy]ethyl]peroxyoctadec-9-enoic acid methyl ester Formula: C34H56O5 MolecularWeight: 544.80544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C=CCCCCCCCC(=O)OC)OOC(C)(C)OC1CCCCC1C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(/C=C\CCCCCCCC(=O)OC)OOC(C)(C)O[C@@H]1CCCC[C@H]1C2=CC=CC=C2

InChI

InChI=1S/C34H56O5/c1-5-6-7-11-17-24-30(25-18-12-9-8-10-13-19-28-33(35)36-4)38-39-34(2,3)37-32-27-21-20-26-31(32)29-22-15-14-16-23-29/h14-16,18,22-23,25,30-32H,5-13,17,19-21,24,26-28H2,1-4H3/b25-18-/t30?,31-,32+/m0/s1