6-[1-(4-methylphenyl)butan-2-yl]-2-oxidanyl-3-(1-thiophen-2-ylpropyl)pyran-4-one

Systemtic Name: 6-[1-(4-methylphenyl)butan-2-yl]-2-oxidanyl-3-(1-thiophen-2-ylpropyl)pyran-4-one Openeye Name: 2-hydroxy-6-[1-(p-tolylmethyl)propyl]-3-[1-(2-thienyl)propyl]pyran-4-one CAS Name: 2-hydroxy-6-[1-(4-methylphenyl)butan-2-yl]-3-(1-thiophen-2-ylpropyl)-4-pyranone IUPAC Name: 2-hydroxy-6-[1-(4-methylphenyl)butan-2-yl]-3-(1-thiophen-2-ylpropyl)pyran-4-one Traditional Name: 2-hydroxy-6-[1-(4-methylbenzyl)propyl]-3-[1-(2-thienyl)propyl]pyran-4-one Formula: C23H26O3S MolecularWeight: 382.51574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26O3S/c1-4-17(13-16-10-8-15(3)9-11-16)20-14-19(24)22(23(25)26-20)18(5-2)21-7-6-12-27-21/h6-12,14,17-18,25H,4-5,13H2,1-3H3