2-oxidanyl-6-phenyl-3-[(4-propan-2-yl-1,3-benzodioxol-5-yl)sulfanyl]pyran-4-one

Systemtic Name: 2-oxidanyl-6-phenyl-3-[(4-propan-2-yl-1,3-benzodioxol-5-yl)sulfanyl]pyran-4-one Openeye Name: 2-hydroxy-3-[(4-isopropyl-1,3-benzodioxol-5-yl)sulfanyl]-6-phenyl-pyran-4-one CAS Name: 2-hydroxy-6-phenyl-3-[(4-propan-2-yl-1,3-benzodioxol-5-yl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-phenyl-3-[(4-propan-2-yl-1,3-benzodioxol-5-yl)sulfanyl]pyran-4-one Traditional Name: 2-hydroxy-3-[(4-isopropyl-1,3-benzodioxol-5-yl)thio]-6-phenyl-pyran-4-one Formula: C21H18O5S MolecularWeight: 382.42962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC2=C1OCO2)SC3=C(OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=C(C=CC2=C1OCO2)SC3=C(OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C21H18O5S/c1-12(2)18-17(9-8-15-19(18)25-11-24-15)27-20-14(22)10-16(26-21(20)23)13-6-4-3-5-7-13/h3-10,12,23H,11H2,1-2H3