3-[cyclopropyl(phenyl)methyl]-2-oxidanyl-6-(2-oxidanyl-2-thiophen-3-yl-ethyl)pyran-4-one

Systemtic Name: 3-[cyclopropyl(phenyl)methyl]-2-oxidanyl-6-(2-oxidanyl-2-thiophen-3-yl-ethyl)pyran-4-one Openeye Name: 3-[cyclopropyl(phenyl)methyl]-2-hydroxy-6-[2-hydroxy-2-(3-thienyl)ethyl]pyran-4-one CAS Name: 3-[cyclopropyl(phenyl)methyl]-2-hydroxy-6-[2-hydroxy-2-(3-thiophenyl)ethyl]-4-pyranone IUPAC Name: 3-[cyclopropyl(phenyl)methyl]-2-hydroxy-6-(2-hydroxy-2-thiophen-3-ylethyl)pyran-4-one Traditional Name: 3-[cyclopropyl(phenyl)methyl]-2-hydroxy-6-[2-hydroxy-2-(3-thienyl)ethyl]pyran-4-one Formula: C21H20O4S MolecularWeight: 368.4461

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CC=C2)C3=C(OC(=CC3=O)CC(C4=CSC=C4)O)O

Isomeric SMILES

C1CC1C(C2=CC=CC=C2)C3=C(OC(=CC3=O)CC(C4=CSC=C4)O)O

InChI

InChI=1S/C21H20O4S/c22-17(15-8-9-26-12-15)10-16-11-18(23)20(21(24)25-16)19(14-6-7-14)13-4-2-1-3-5-13/h1-5,8-9,11-12,14,17,19,22,24H,6-7,10H2