[3,5-bis(oxan-2-yloxy)-4-(3-oxidanylidenebutyl)phenyl]methyl hexadecanoate

Systemtic Name: [3,5-bis(oxan-2-yloxy)-4-(3-oxidanylidenebutyl)phenyl]methyl hexadecanoate Openeye Name: [4-(3-oxobutyl)-3,5-di(tetrahydropyran-2-yloxy)phenyl]methyl hexadecanoate CAS Name: hexadecanoic acid [3,5-bis(2-oxanyloxy)-4-(3-oxobutyl)phenyl]methyl ester IUPAC Name: [3,5-bis(oxan-2-yloxy)-4-(3-oxobutyl)phenyl]methyl hexadecanoate Traditional Name: palmitic acid [4-(3-ketobutyl)-3,5-di(tetrahydropyran-2-yloxy)benzyl] ester Formula: C37H60O7 MolecularWeight: 616.8681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1=CC(=C(C(=C1)OC2CCCCO2)CCC(=O)C)OC3CCCCO3

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC1=CC(=C(C(=C1)OC2CCCCO2)CCC(=O)C)OC3CCCCO3

InChI

InChI=1S/C37H60O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-35(39)42-29-31-27-33(43-36-21-16-18-25-40-36)32(24-23-30(2)38)34(28-31)44-37-22-17-19-26-41-37/h27-28,36-37H,3-26,29H2,1-2H3