4-(3,5-dimethylphenoxy)-5-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-3-iodanyl-6-methyl-1H-pyridin-2-one

Systemtic Name: 4-(3,5-dimethylphenoxy)-5-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-3-iodanyl-6-methyl-1H-pyridin-2-one Openeye Name: 5-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-4-(3,5-dimethylphenoxy)-3-iodo-6-methyl-1H-pyridin-2-one CAS Name: 5-[[4-(4-acetylphenyl)-1-piperazinyl]methyl]-4-(3,5-dimethylphenoxy)-3-iodo-6-methyl-1H-pyridin-2-one IUPAC Name: 5-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-4-(3,5-dimethylphenoxy)-3-iodo-6-methyl-1H-pyridin-2-one Traditional Name: 5-[[4-(4-acetylphenyl)piperazino]methyl]-4-(3,5-dimethylphenoxy)-3-iodo-6-methyl-2-pyridone Formula: C27H30IN3O3 MolecularWeight: 571.44987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(C(=O)NC(=C2CN3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C)I)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(C(=O)NC(=C2CN3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C)I)C

InChI

InChI=1S/C27H30IN3O3/c1-17-13-18(2)15-23(14-17)34-26-24(19(3)29-27(33)25(26)28)16-30-9-11-31(12-10-30)22-7-5-21(6-8-22)20(4)32/h5-8,13-15H,9-12,16H2,1-4H3,(H,29,33)