2-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-6-methyl-3-oxidanyl-pyran-4-one

Systemtic Name: 2-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]-6-methyl-3-oxidanyl-pyran-4-one Openeye Name: 2-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-3-hydroxy-6-methyl-pyran-4-one CAS Name: 2-[[4-(4-acetylphenyl)-1-piperazinyl]methyl]-3-hydroxy-6-methyl-4-pyranone IUPAC Name: 2-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-3-hydroxy-6-methylpyran-4-one Traditional Name: 2-[[4-(4-acetylphenyl)piperazino]methyl]-3-hydroxy-6-methyl-pyran-4-one Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)CN2CCN(CC2)C3=CC=C(C=C3)C(=O)C)O

Isomeric SMILES

CC1=CC(=O)C(=C(O1)CN2CCN(CC2)C3=CC=C(C=C3)C(=O)C)O

InChI

InChI=1S/C19H22N2O4/c1-13-11-17(23)19(24)18(25-13)12-20-7-9-21(10-8-20)16-5-3-15(4-6-16)14(2)22/h3-6,11,24H,7-10,12H2,1-2H3