3-(1-cyclopentylsulfanyl-2-cyclopropyl-ethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-pyran-4-one

Systemtic Name: 3-(1-cyclopentylsulfanyl-2-cyclopropyl-ethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-pyran-4-one Openeye Name: 3-(1-cyclopentylsulfanyl-2-cyclopropyl-ethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-pyran-4-one CAS Name: 3-[1-(cyclopentylthio)-2-cyclopropylethyl]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-pyranone IUPAC Name: 3-(1-cyclopentylsulfanyl-2-cyclopropylethyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxypyran-4-one Traditional Name: 3-[1-(cyclopentylthio)-2-cyclopropyl-ethyl]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-pyran-4-one Formula: C23H26O5S MolecularWeight: 414.51454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC(CC2CC2)C3=C(OC(=CC3=O)C4=CC5=C(C=C4)OCCO5)O

Isomeric SMILES

C1CCC(C1)SC(CC2CC2)C3=C(OC(=CC3=O)C4=CC5=C(C=C4)OCCO5)O

InChI

InChI=1S/C23H26O5S/c24-17-13-19(15-7-8-18-20(12-15)27-10-9-26-18)28-23(25)22(17)21(11-14-5-6-14)29-16-3-1-2-4-16/h7-8,12-14,16,21,25H,1-6,9-11H2