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

Systemtic Name: 5-(3,4-dimethylphenyl)-3-[(3-methyl-4-oxidanyl-phenyl)methyl]piperidin-2-one Openeye Name: 5-(3,4-dimethylphenyl)-3-[(4-hydroxy-3-methyl-phenyl)methyl]piperidin-2-one CAS Name: 5-(3,4-dimethylphenyl)-3-[(4-hydroxy-3-methylphenyl)methyl]-2-piperidinone IUPAC Name: 5-(3,4-dimethylphenyl)-3-[(4-hydroxy-3-methylphenyl)methyl]piperidin-2-one Traditional Name: 5-(3,4-dimethylphenyl)-3-(4-hydroxy-3-methyl-benzyl)-2-piperidone Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2CC(C(=O)NC2)CC3=CC(=C(C=C3)O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2CC(C(=O)NC2)CC3=CC(=C(C=C3)O)C)C

InChI

InChI=1S/C21H25NO2/c1-13-4-6-17(9-14(13)2)19-11-18(21(24)22-12-19)10-16-5-7-20(23)15(3)8-16/h4-9,18-19,23H,10-12H2,1-3H3,(H,22,24)