methyl 3-[6-[3-[4-(hydroxymethyl)-3-oxidanyl-5-oxidanylidene-5-phenylmethoxy-pentyl]phenyl]hexyl]benzoate

Systemtic Name: methyl 3-[6-[3-[4-(hydroxymethyl)-3-oxidanyl-5-oxidanylidene-5-phenylmethoxy-pentyl]phenyl]hexyl]benzoate Openeye Name: methyl 3-[6-[3-[5-benzyloxy-3-hydroxy-4-(hydroxymethyl)-5-oxo-pentyl]phenyl]hexyl]benzoate CAS Name: 3-[6-[3-[3-hydroxy-4-(hydroxymethyl)-5-oxo-5-phenylmethoxypentyl]phenyl]hexyl]benzoic acid methyl ester IUPAC Name: methyl 3-[6-[3-[3-hydroxy-4-(hydroxymethyl)-5-oxo-5-phenylmethoxypentyl]phenyl]hexyl]benzoate Traditional Name: 3-[6-[3-(5-benzoxy-3-hydroxy-5-keto-4-methylol-pentyl)phenyl]hexyl]benzoic acid methyl ester Formula: C33H40O6 MolecularWeight: 532.6671

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CCCCCCC2=CC(=CC=C2)CCC(C(CO)C(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CCCCCCC2=CC(=CC=C2)CCC(C(CO)C(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C33H40O6/c1-38-32(36)29-18-10-17-26(22-29)12-6-3-2-5-11-25-15-9-16-27(21-25)19-20-31(35)30(23-34)33(37)39-24-28-13-7-4-8-14-28/h4,7-10,13-18,21-22,30-31,34-35H,2-3,5-6,11-12,19-20,23-24H2,1H3