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

Systemtic Name: 3-[(E)-3-(4-heptoxyphenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[(E)-3-(4-heptoxyphenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[(E)-3-(4-heptoxyphenyl)-1-oxoprop-2-enyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[(E)-3-(4-heptoxyphenyl)prop-2-enoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[(E)-3-(4-heptoxyphenyl)acryloyl]-6-methyl-pyran-2,4-quinone Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C=CC(=O)C2C(=O)C=C(OC2=O)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)C2C(=O)C=C(OC2=O)C

InChI

InChI=1S/C22H26O5/c1-3-4-5-6-7-14-26-18-11-8-17(9-12-18)10-13-19(23)21-20(24)15-16(2)27-22(21)25/h8-13,15,21H,3-7,14H2,1-2H3/b13-10+