6-methyl-3-[(E)-3-(3-methylphenyl)prop-2-enoyl]-4-(4-oxidanylidenepentoxy)pyran-2-one

Systemtic Name: 6-methyl-3-[(E)-3-(3-methylphenyl)prop-2-enoyl]-4-(4-oxidanylidenepentoxy)pyran-2-one Openeye Name: 6-methyl-3-[(E)-3-(m-tolyl)prop-2-enoyl]-4-(4-oxopentoxy)pyran-2-one CAS Name: 6-methyl-3-[(E)-3-(3-methylphenyl)-1-oxoprop-2-enyl]-4-(4-oxopentoxy)-2-pyranone IUPAC Name: 6-methyl-3-[(E)-3-(3-methylphenyl)prop-2-enoyl]-4-(4-oxopentoxy)pyran-2-one Traditional Name: 4-(4-ketopentoxy)-6-methyl-3-[(E)-3-(m-tolyl)acryloyl]pyran-2-one Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC(=O)C2=C(C=C(OC2=O)C)OCCCC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C(=O)C2=C(C=C(OC2=O)C)OCCCC(=O)C

InChI

InChI=1S/C21H22O5/c1-14-6-4-8-17(12-14)9-10-18(23)20-19(13-16(3)26-21(20)24)25-11-5-7-15(2)22/h4,6,8-10,12-13H,5,7,11H2,1-3H3/b10-9+