2-oxidanyl-6-phenyl-3-(4-phenylbutylsulfanyl)pyran-4-one

Systemtic Name: 2-oxidanyl-6-phenyl-3-(4-phenylbutylsulfanyl)pyran-4-one Openeye Name: 2-hydroxy-6-phenyl-3-(4-phenylbutylsulfanyl)pyran-4-one CAS Name: 2-hydroxy-6-phenyl-3-(4-phenylbutylthio)-4-pyranone IUPAC Name: 2-hydroxy-6-phenyl-3-(4-phenylbutylsulfanyl)pyran-4-one Traditional Name: 2-hydroxy-6-phenyl-3-(4-phenylbutylthio)pyran-4-one Formula: C21H20O3S MolecularWeight: 352.4467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCSC2=C(OC(=CC2=O)C3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCSC2=C(OC(=CC2=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H20O3S/c22-18-15-19(17-12-5-2-6-13-17)24-21(23)20(18)25-14-8-7-11-16-9-3-1-4-10-16/h1-6,9-10,12-13,15,23H,7-8,11,14H2