[2-[4-(4-methoxyphenyl)butanoyloxy]-3-phenylmethoxy-propyl] undec-10-ynoate

Systemtic Name: [2-[4-(4-methoxyphenyl)butanoyloxy]-3-phenylmethoxy-propyl] undec-10-ynoate Openeye Name: [3-benzyloxy-2-[4-(4-methoxyphenyl)butanoyloxy]propyl] undec-10-ynoate CAS Name: 10-undecynoic acid [2-[4-(4-methoxyphenyl)-1-oxobutoxy]-3-phenylmethoxypropyl] ester IUPAC Name: [2-[4-(4-methoxyphenyl)butanoyloxy]-3-phenylmethoxypropyl] undec-10-ynoate Traditional Name: undec-10-ynoic acid [3-benzoxy-2-[4-(4-methoxyphenyl)butanoyloxy]propyl] ester Formula: C32H42O6 MolecularWeight: 522.67228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCC(=O)OC(COCC2=CC=CC=C2)COC(=O)CCCCCCCCC#C

Isomeric SMILES

COC1=CC=C(C=C1)CCCC(=O)OC(COCC2=CC=CC=C2)COC(=O)CCCCCCCCC#C

InChI

InChI=1S/C32H42O6/c1-3-4-5-6-7-8-9-13-18-31(33)37-26-30(25-36-24-28-15-11-10-12-16-28)38-32(34)19-14-17-27-20-22-29(35-2)23-21-27/h1,10-12,15-16,20-23,30H,4-9,13-14,17-19,24-26H2,2H3