5-(3,4-dimethylphenyl)-3-[(3-methyl-4-oxidanyl-phenyl)methyl]oxan-2-one

Systemtic Name: 5-(3,4-dimethylphenyl)-3-[(3-methyl-4-oxidanyl-phenyl)methyl]oxan-2-one Openeye Name: 5-(3,4-dimethylphenyl)-3-[(4-hydroxy-3-methyl-phenyl)methyl]tetrahydropyran-2-one CAS Name: 5-(3,4-dimethylphenyl)-3-[(4-hydroxy-3-methylphenyl)methyl]-2-oxanone IUPAC Name: 5-(3,4-dimethylphenyl)-3-[(4-hydroxy-3-methylphenyl)methyl]oxan-2-one Traditional Name: 5-(3,4-dimethylphenyl)-3-(4-hydroxy-3-methyl-benzyl)tetrahydropyran-2-one Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2CC(C(=O)OC2)CC3=CC(=C(C=C3)O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2CC(C(=O)OC2)CC3=CC(=C(C=C3)O)C)C

InChI

InChI=1S/C21H24O3/c1-13-4-6-17(9-14(13)2)19-11-18(21(23)24-12-19)10-16-5-7-20(22)15(3)8-16/h4-9,18-19,22H,10-12H2,1-3H3