(E,5R)-5-oxidanyl-9-phenylmethoxy-non-2-enal

Systemtic Name: (E,5R)-5-oxidanyl-9-phenylmethoxy-non-2-enal Openeye Name: (E,5R)-9-benzyloxy-5-hydroxy-non-2-enal CAS Name: (E,5R)-5-hydroxy-9-phenylmethoxy-2-nonenal IUPAC Name: (E,5R)-5-hydroxy-9-phenylmethoxynon-2-enal Traditional Name: (E,5R)-9-benzoxy-5-hydroxy-non-2-enal Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCCC(CC=CC=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCCC[C@H](C/C=C/C=O)O

InChI

InChI=1S/C16H22O3/c17-12-6-4-10-16(18)11-5-7-13-19-14-15-8-2-1-3-9-15/h1-4,6,8-9,12,16,18H,5,7,10-11,13-14H2/b6-4+/t16-/m0/s1