(E)-3-(2,2-dimethyl-4H-1,3-benzodioxin-5-yl)prop-2-enal

Systemtic Name: (E)-3-(2,2-dimethyl-4H-1,3-benzodioxin-5-yl)prop-2-enal Openeye Name: (E)-3-(2,2-dimethyl-4H-1,3-benzodioxin-5-yl)prop-2-enal CAS Name: (E)-3-(2,2-dimethyl-4H-1,3-benzodioxin-5-yl)-2-propenal IUPAC Name: (E)-3-(2,2-dimethyl-4H-1,3-benzodioxin-5-yl)prop-2-enal Traditional Name: (E)-3-(2,2-dimethyl-4H-1,3-benzodioxin-5-yl)acrolein Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC2=C(C=CC=C2O1)C=CC=O)C

Isomeric SMILES

CC1(OCC2=C(C=CC=C2O1)/C=C/C=O)C

InChI

InChI=1S/C13H14O3/c1-13(2)15-9-11-10(6-4-8-14)5-3-7-12(11)16-13/h3-8H,9H2,1-2H3/b6-4+