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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]piperidin-2-one Openeye Name: 5-(3,4-dimethoxyphenyl)-3-[(4-hydroxy-3-methoxy-phenyl)methyl]piperidin-2-one CAS Name: 5-(3,4-dimethoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2-piperidinone IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-2-one Traditional Name: 5-(3,4-dimethoxyphenyl)-3-vanillyl-2-piperidone Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(C(=O)NC2)CC3=CC(=C(C=C3)O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(C(=O)NC2)CC3=CC(=C(C=C3)O)OC)OC

InChI

InChI=1S/C21H25NO5/c1-25-18-7-5-14(11-20(18)27-3)16-10-15(21(24)22-12-16)8-13-4-6-17(23)19(9-13)26-2/h4-7,9,11,15-16,23H,8,10,12H2,1-3H3,(H,22,24)