6-methyl-3-[(E)-3-[4-(3-methylbutoxy)phenyl]prop-2-enoyl]pyran-2,4-dione

Systemtic Name: 6-methyl-3-[(E)-3-[4-(3-methylbutoxy)phenyl]prop-2-enoyl]pyran-2,4-dione Openeye Name: 3-[(E)-3-(4-isopentyloxyphenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 6-methyl-3-[(E)-3-[4-(3-methylbutoxy)phenyl]-1-oxoprop-2-enyl]pyran-2,4-dione IUPAC Name: 6-methyl-3-[(E)-3-[4-(3-methylbutoxy)phenyl]prop-2-enoyl]pyran-2,4-dione Traditional Name: 3-[(E)-3-(4-isoamoxyphenyl)acryloyl]-6-methyl-pyran-2,4-quinone Formula: C20H22O5 MolecularWeight: 342.38568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)/C=C/C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C20H22O5/c1-13(2)10-11-24-16-7-4-15(5-8-16)6-9-17(21)19-18(22)12-14(3)25-20(19)23/h4-9,12-13,19H,10-11H2,1-3H3/b9-6+