(3-phenylmethoxy-2-undec-10-ynoyloxy-propyl) undec-10-ynoate

Systemtic Name: (3-phenylmethoxy-2-undec-10-ynoyloxy-propyl) undec-10-ynoate Openeye Name: (3-benzyloxy-2-undec-10-ynoyloxy-propyl) undec-10-ynoate CAS Name: 10-undecynoic acid [2-(1-oxoundec-10-ynoxy)-3-phenylmethoxypropyl] ester IUPAC Name: (3-phenylmethoxy-2-undec-10-ynoyloxypropyl) undec-10-ynoate Traditional Name: undec-10-ynoic acid (3-benzoxy-2-undec-10-ynoyloxy-propyl) ester Formula: C32H46O5 MolecularWeight: 510.70464

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCCCCCCC(=O)OCC(COCC1=CC=CC=C1)OC(=O)CCCCCCCCC#C

Isomeric SMILES

C#CCCCCCCCCC(=O)OCC(COCC1=CC=CC=C1)OC(=O)CCCCCCCCC#C

InChI

InChI=1S/C32H46O5/c1-3-5-7-9-11-13-15-20-24-31(33)36-28-30(27-35-26-29-22-18-17-19-23-29)37-32(34)25-21-16-14-12-10-8-6-4-2/h1-2,17-19,22-23,30H,5-16,20-21,24-28H2