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

Systemtic Name: 3-(cyclohexylmethylsulfanyl)-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-(cyclohexylmethylsulfanyl)-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-(cyclohexylmethylthio)-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-(cyclohexylmethylsulfanyl)-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-(cyclohexylmethylthio)-2-hydroxy-6-phenyl-pyran-4-one Formula: C18H20O3S MolecularWeight: 316.4146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CSC2=C(OC(=CC2=O)C3=CC=CC=C3)O

Isomeric SMILES

C1CCC(CC1)CSC2=C(OC(=CC2=O)C3=CC=CC=C3)O

InChI

InChI=1S/C18H20O3S/c19-15-11-16(14-9-5-2-6-10-14)21-18(20)17(15)22-12-13-7-3-1-4-8-13/h2,5-6,9-11,13,20H,1,3-4,7-8,12H2