(E)-1-(4-methoxyphenyl)pent-1-en-3-one; (E)-3-(2-methoxyphenyl)prop-2-enal

Systemtic Name: (E)-1-(4-methoxyphenyl)pent-1-en-3-one; (E)-3-(2-methoxyphenyl)prop-2-enal Openeye Name: (E)-1-(4-methoxyphenyl)pent-1-en-3-one; (E)-3-(2-methoxyphenyl)prop-2-enal CAS Name: (E)-1-(4-methoxyphenyl)-1-penten-3-one; (E)-3-(2-methoxyphenyl)-2-propenal IUPAC Name: (E)-1-(4-methoxyphenyl)pent-1-en-3-one; (E)-3-(2-methoxyphenyl)prop-2-enal Traditional Name: (E)-3-(2-methoxyphenyl)acrolein; (E)-1-(4-methoxyphenyl)pent-1-en-3-one Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C=CC1=CC=C(C=C1)OC.COC1=CC=CC=C1C=CC=O

Isomeric SMILES

CCC(=O)/C=C/C1=CC=C(C=C1)OC.COC1=CC=CC=C1/C=C/C=O

InChI

InChI=1S/C12H14O2.C10H10O2/c1-3-11(13)7-4-10-5-8-12(14-2)9-6-10;1-12-10-7-3-2-5-9(10)6-4-8-11/h4-9H,3H2,1-2H3;2-8H,1H3/b7-4+;6-4+