(phenylmethyl) 2-heptyl-4-[4-methoxy-2-oxidanyl-6-(2-oxidanylideneheptyl)phenyl]carbonyloxy-6-oxidanyl-benzoate

Systemtic Name: (phenylmethyl) 2-heptyl-4-[4-methoxy-2-oxidanyl-6-(2-oxidanylideneheptyl)phenyl]carbonyloxy-6-oxidanyl-benzoate Openeye Name: benzyl 2-heptyl-6-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoyl]oxy-benzoate CAS Name: 2-heptyl-6-hydroxy-4-[[2-hydroxy-4-methoxy-6-(2-oxoheptyl)phenyl]-oxomethoxy]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-heptyl-6-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoyl]oxybenzoate Traditional Name: 2-heptyl-6-hydroxy-4-[2-hydroxy-6-(2-ketoheptyl)-4-methoxy-benzoyl]oxy-benzoic acid benzyl ester Formula: C36H44O8 MolecularWeight: 604.72976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=CC(=C1C(=O)OCC2=CC=CC=C2)O)OC(=O)C3=C(C=C(C=C3CC(=O)CCCCC)OC)O

Isomeric SMILES

CCCCCCCC1=CC(=CC(=C1C(=O)OCC2=CC=CC=C2)O)OC(=O)C3=C(C=C(C=C3CC(=O)CCCCC)OC)O

InChI

InChI=1S/C36H44O8/c1-4-6-8-9-14-17-26-20-30(23-32(39)33(26)35(40)43-24-25-15-12-10-13-16-25)44-36(41)34-27(19-28(37)18-11-7-5-2)21-29(42-3)22-31(34)38/h10,12-13,15-16,20-23,38-39H,4-9,11,14,17-19,24H2,1-3H3