(2R,4S,5S)-5-[dioxidanyl(methoxy)methyl]-2-methyl-4-oxidanyl-2-phenylmethoxy-nonanal

Systemtic Name: (2R,4S,5S)-5-[dioxidanyl(methoxy)methyl]-2-methyl-4-oxidanyl-2-phenylmethoxy-nonanal Openeye Name: (2R,4S,5S)-2-benzyloxy-5-[hydroperoxy(methoxy)methyl]-4-hydroxy-2-methyl-nonanal CAS Name: (2R,4S,5S)-5-[hydroperoxy(methoxy)methyl]-4-hydroxy-2-methyl-2-phenylmethoxynonanal IUPAC Name: (2R,4S,5S)-5-[hydroperoxy(methoxy)methyl]-4-hydroxy-2-methyl-2-phenylmethoxynonanal Traditional Name: (2R,4S,5S)-2-benzoxy-5-[hydroperoxy(methoxy)methyl]-4-hydroxy-2-methyl-pelargonaldehyde Formula: C19H30O6 MolecularWeight: 354.4379

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC(C)(C=O)OCC1=CC=CC=C1)O)C(OC)OO

Isomeric SMILES

CCCC[C@@H]([C@H](C[C@](C)(C=O)OCC1=CC=CC=C1)O)C(OC)OO

InChI

InChI=1S/C19H30O6/c1-4-5-11-16(18(23-3)25-22)17(21)12-19(2,14-20)24-13-15-9-7-6-8-10-15/h6-10,14,16-18,21-22H,4-5,11-13H2,1-3H3/t16-,17-,18?,19+/m0/s1