4-[[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[4-(2,4-dichlorobenzoyl)piperazin-1-yl]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-(2,4-dichlorobenzoyl)piperazin-1-yl]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[4-(2,4-dichlorobenzoyl)piperazino]methyl]-7-methoxy-coumarin Formula: C22H20Cl2N2O4 MolecularWeight: 447.3112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H20Cl2N2O4/c1-29-16-3-5-17-14(10-21(27)30-20(17)12-16)13-25-6-8-26(9-7-25)22(28)18-4-2-15(23)11-19(18)24/h2-5,10-12H,6-9,13H2,1H3