[3-phenylmethoxy-5-[3-(9-phenylnonanoyloxy)tetradecanoylamino]oxan-4-yl] 9-phenylnonanoate

Systemtic Name: [3-phenylmethoxy-5-[3-(9-phenylnonanoyloxy)tetradecanoylamino]oxan-4-yl] 9-phenylnonanoate Openeye Name: [3-benzyloxy-5-[3-(9-phenylnonanoyloxy)tetradecanoylamino]tetrahydropyran-4-yl] 9-phenylnonanoate CAS Name: 9-phenylnonanoic acid [3-[[1-oxo-3-(1-oxo-9-phenylnonoxy)tetradecyl]amino]-5-phenylmethoxy-4-oxanyl] ester IUPAC Name: [3-phenylmethoxy-5-[3-(9-phenylnonanoyloxy)tetradecanoylamino]oxan-4-yl] 9-phenylnonanoate Traditional Name: 9-phenylpelargonic acid [3-benzoxy-5-[3-(9-phenylnonanoyloxy)tetradecanoylamino]tetrahydropyran-4-yl] ester Formula: C56H83NO7 MolecularWeight: 882.26072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)NC1COCC(C1OC(=O)CCCCCCCCC2=CC=CC=C2)OCC3=CC=CC=C3)OC(=O)CCCCCCCCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCC(CC(=O)NC1COCC(C1OC(=O)CCCCCCCCC2=CC=CC=C2)OCC3=CC=CC=C3)OC(=O)CCCCCCCCC4=CC=CC=C4

InChI

InChI=1S/C56H83NO7/c1-2-3-4-5-6-7-8-15-29-40-50(63-54(59)41-30-16-11-9-13-21-32-47-34-23-18-24-35-47)43-53(58)57-51-45-61-46-52(62-44-49-38-27-20-28-39-49)56(51)64-55(60)42-31-17-12-10-14-22-33-48-36-25-19-26-37-48/h18-20,23-28,34-39,50-52,56H,2-17,21-22,29-33,40-46H2,1H3,(H,57,58)