3-[(E)-3-(2-methoxy-4-methylsulfanyl-phenyl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-(2-methoxy-4-methylsulfanyl-phenyl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 2-hydroxy-3-[(E)-3-(2-methoxy-4-methylsulfanyl-phenyl)prop-2-enoyl]-6-methyl-pyran-4-one CAS Name: 2-hydroxy-3-[(E)-3-[2-methoxy-4-(methylthio)phenyl]-1-oxoprop-2-enyl]-6-methyl-4-pyranone IUPAC Name: 2-hydroxy-3-[(E)-3-(2-methoxy-4-methylsulfanylphenyl)prop-2-enoyl]-6-methylpyran-4-one Traditional Name: 2-hydroxy-3-[(E)-3-[2-methoxy-4-(methylthio)phenyl]acryloyl]-6-methyl-pyran-4-one Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=C(C=C(C=C2)SC)OC

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=C(C=C(C=C2)SC)OC

InChI

InChI=1S/C17H16O5S/c1-10-8-14(19)16(17(20)22-10)13(18)7-5-11-4-6-12(23-3)9-15(11)21-2/h4-9,20H,1-3H3/b7-5+