6,8-bis(chloranyl)-3-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]chromen-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-[[4-(4-ethanoylphenyl)piperazin-1-yl]methyl]chromen-4-one Openeye Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-6,8-dichloro-chromen-4-one CAS Name: 3-[[4-(4-acetylphenyl)-1-piperazinyl]methyl]-6,8-dichloro-1-benzopyran-4-one IUPAC Name: 3-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-6,8-dichlorochromen-4-one Traditional Name: 3-[[4-(4-acetylphenyl)piperazino]methyl]-6,8-dichloro-chromone Formula: C22H20Cl2N2O3 MolecularWeight: 431.3118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=COC4=C(C=C(C=C4C3=O)Cl)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC3=COC4=C(C=C(C=C4C3=O)Cl)Cl

InChI

InChI=1S/C22H20Cl2N2O3/c1-14(27)15-2-4-18(5-3-15)26-8-6-25(7-9-26)12-16-13-29-22-19(21(16)28)10-17(23)11-20(22)24/h2-5,10-11,13H,6-9,12H2,1H3