[2-(8-methoxyoctanoyloxy)-3-phenylmethoxy-propyl] hexadec-15-ynoate

Systemtic Name: [2-(8-methoxyoctanoyloxy)-3-phenylmethoxy-propyl] hexadec-15-ynoate Openeye Name: [3-benzyloxy-2-(8-methoxyoctanoyloxy)propyl] hexadec-15-ynoate CAS Name: 15-hexadecynoic acid [2-(8-methoxy-1-oxooctoxy)-3-phenylmethoxypropyl] ester IUPAC Name: [2-(8-methoxyoctanoyloxy)-3-phenylmethoxypropyl] hexadec-15-ynoate Traditional Name: hexadec-15-ynoic acid [3-benzoxy-2-(8-methoxyoctanoyloxy)propyl] ester Formula: C35H56O6 MolecularWeight: 572.81554

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCCC(=O)OC(COCC1=CC=CC=C1)COC(=O)CCCCCCCCCCCCCC#C

Isomeric SMILES

COCCCCCCCC(=O)OC(COCC1=CC=CC=C1)COC(=O)CCCCCCCCCCCCCC#C

InChI

InChI=1S/C35H56O6/c1-3-4-5-6-7-8-9-10-11-12-13-15-21-26-34(36)40-31-33(30-39-29-32-24-19-18-20-25-32)41-35(37)27-22-16-14-17-23-28-38-2/h1,18-20,24-25,33H,4-17,21-23,26-31H2,2H3