2-oxidanyl-6-(1-phenylbutan-2-yl)-3-(1-thiophen-2-ylpropyl)pyran-4-one

Systemtic Name: 2-oxidanyl-6-(1-phenylbutan-2-yl)-3-(1-thiophen-2-ylpropyl)pyran-4-one Openeye Name: 6-(1-benzylpropyl)-2-hydroxy-3-[1-(2-thienyl)propyl]pyran-4-one CAS Name: 2-hydroxy-6-(1-phenylbutan-2-yl)-3-(1-thiophen-2-ylpropyl)-4-pyranone IUPAC Name: 2-hydroxy-6-(1-phenylbutan-2-yl)-3-(1-thiophen-2-ylpropyl)pyran-4-one Traditional Name: 6-(1-benzylpropyl)-2-hydroxy-3-[1-(2-thienyl)propyl]pyran-4-one Formula: C22H24O3S MolecularWeight: 368.48916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(CC)C3=CC=CS3

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(CC)C3=CC=CS3

InChI

InChI=1S/C22H24O3S/c1-3-16(13-15-9-6-5-7-10-15)19-14-18(23)21(22(24)25-19)17(4-2)20-11-8-12-26-20/h5-12,14,16-17,24H,3-4,13H2,1-2H3