(E)-3-[3-oxidanyl-3-(2-oxidanylpropan-2-yl)-2H-1,4-benzodioxin-6-yl]prop-2-enal

Systemtic Name: (E)-3-[3-oxidanyl-3-(2-oxidanylpropan-2-yl)-2H-1,4-benzodioxin-6-yl]prop-2-enal Openeye Name: (E)-3-[3-hydroxy-3-(1-hydroxy-1-methyl-ethyl)-2H-1,4-benzodioxin-6-yl]prop-2-enal CAS Name: (E)-3-[3-hydroxy-3-(2-hydroxypropan-2-yl)-2H-1,4-benzodioxin-6-yl]-2-propenal IUPAC Name: (E)-3-[3-hydroxy-3-(2-hydroxypropan-2-yl)-2H-1,4-benzodioxin-6-yl]prop-2-enal Traditional Name: (E)-3-[3-hydroxy-3-(1-hydroxy-1-methyl-ethyl)-2H-1,4-benzodioxin-6-yl]acrolein Formula: C14H16O5 MolecularWeight: 264.27384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1(COC2=C(O1)C=C(C=C2)C=CC=O)O)O

Isomeric SMILES

CC(C)(C1(COC2=C(O1)C=C(C=C2)/C=C/C=O)O)O

InChI

InChI=1S/C14H16O5/c1-13(2,16)14(17)9-18-11-6-5-10(4-3-7-15)8-12(11)19-14/h3-8,16-17H,9H2,1-2H3/b4-3+