(3R)-3-[(S)-(4-methylphenyl)-oxidanyl-methyl]oxan-4-one

Systemtic Name: (3R)-3-[(S)-(4-methylphenyl)-oxidanyl-methyl]oxan-4-one Openeye Name: (3R)-3-[(S)-hydroxy(p-tolyl)methyl]tetrahydropyran-4-one CAS Name: (3R)-3-[(S)-hydroxy-(4-methylphenyl)methyl]-4-oxanone IUPAC Name: (3R)-3-[(S)-hydroxy-(4-methylphenyl)methyl]oxan-4-one Traditional Name: (3R)-3-[(S)-hydroxy(p-tolyl)methyl]tetrahydropyran-4-one Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2COCCC2=O)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@H]2COCCC2=O)O

InChI

InChI=1S/C13H16O3/c1-9-2-4-10(5-3-9)13(15)11-8-16-7-6-12(11)14/h2-5,11,13,15H,6-8H2,1H3/t11-,13+/m0/s1