4-methoxy-6-[(7E,9E)-2-oxidanylundeca-7,9-dienyl]-3-(phenylsulfanylmethyl)pyran-2-one

Systemtic Name: 4-methoxy-6-[(7E,9E)-2-oxidanylundeca-7,9-dienyl]-3-(phenylsulfanylmethyl)pyran-2-one Openeye Name: 6-[(7E,9E)-2-hydroxyundeca-7,9-dienyl]-4-methoxy-3-(phenylsulfanylmethyl)pyran-2-one CAS Name: 6-[(7E,9E)-2-hydroxyundeca-7,9-dienyl]-4-methoxy-3-[(phenylthio)methyl]-2-pyranone IUPAC Name: 6-[(7E,9E)-2-hydroxyundeca-7,9-dienyl]-4-methoxy-3-(phenylsulfanylmethyl)pyran-2-one Traditional Name: 6-[(7E,9E)-2-hydroxyundeca-7,9-dienyl]-4-methoxy-3-[(phenylthio)methyl]pyran-2-one Formula: C24H30O4S MolecularWeight: 414.5576

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CCCCCC(CC1=CC(=C(C(=O)O1)CSC2=CC=CC=C2)OC)O

Isomeric SMILES

C/C=C/C=C/CCCCC(CC1=CC(=C(C(=O)O1)CSC2=CC=CC=C2)OC)O

InChI

InChI=1S/C24H30O4S/c1-3-4-5-6-7-8-10-13-19(25)16-20-17-23(27-2)22(24(26)28-20)18-29-21-14-11-9-12-15-21/h3-6,9,11-12,14-15,17,19,25H,7-8,10,13,16,18H2,1-2H3/b4-3+,6-5+