(E,5S)-6-(4-methoxyphenoxy)-5-oxidanyl-hex-2-enal

Systemtic Name: (E,5S)-6-(4-methoxyphenoxy)-5-oxidanyl-hex-2-enal Openeye Name: (E,5S)-5-hydroxy-6-(4-methoxyphenoxy)hex-2-enal CAS Name: (E,5S)-5-hydroxy-6-(4-methoxyphenoxy)-2-hexenal IUPAC Name: (E,5S)-5-hydroxy-6-(4-methoxyphenoxy)hex-2-enal Traditional Name: (E,5S)-5-hydroxy-6-(4-methoxyphenoxy)hex-2-enal Formula: C13H16O4 MolecularWeight: 236.26374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(CC=CC=O)O

Isomeric SMILES

COC1=CC=C(C=C1)OC[C@H](C/C=C/C=O)O

InChI

InChI=1S/C13H16O4/c1-16-12-5-7-13(8-6-12)17-10-11(15)4-2-3-9-14/h2-3,5-9,11,15H,4,10H2,1H3/b3-2+/t11-/m0/s1