(4-hexadecanoyl-5-oxidanyl-3-oxidanylidene-furan-2-yl)methyl 4-(phenylcarbonyl)benzoate

Systemtic Name: (4-hexadecanoyl-5-oxidanyl-3-oxidanylidene-furan-2-yl)methyl 4-(phenylcarbonyl)benzoate Openeye Name: (4-hexadecanoyl-5-hydroxy-3-oxo-2-furyl)methyl 4-benzoylbenzoate CAS Name: 4-benzoylbenzoic acid [5-hydroxy-3-oxo-4-(1-oxohexadecyl)-2-furanyl]methyl ester IUPAC Name: (4-hexadecanoyl-5-hydroxy-3-oxofuran-2-yl)methyl 4-benzoylbenzoate Traditional Name: 4-benzoylbenzoic acid (4-hexadecanoyl-5-hydroxy-3-keto-2-furyl)methyl ester Formula: C35H44O7 MolecularWeight: 576.71966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1=C(OC(C1=O)COC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1=C(OC(C1=O)COC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C35H44O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-29(36)31-33(38)30(42-35(31)40)25-41-34(39)28-23-21-27(22-24-28)32(37)26-18-15-14-16-19-26/h14-16,18-19,21-24,30,40H,2-13,17,20,25H2,1H3