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

Systemtic Name: 3-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[(E)-3-(4-butoxy-3-ethoxyphenyl)-1-oxoprop-2-enyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[(E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[(E)-3-(4-butoxy-3-ethoxy-phenyl)acryloyl]-6-methyl-pyran-2,4-quinone Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)C2C(=O)C=C(OC2=O)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)C2C(=O)C=C(OC2=O)C)OCC

InChI

InChI=1S/C21H24O6/c1-4-6-11-26-18-10-8-15(13-19(18)25-5-2)7-9-16(22)20-17(23)12-14(3)27-21(20)24/h7-10,12-13,20H,4-6,11H2,1-3H3/b9-7+