3-(4-chlorophenyl)-8-[(4-methylpiperazin-1-yl)methyl]-2,7-bis(oxidanyl)chromen-4-one

Systemtic Name: 3-(4-chlorophenyl)-8-[(4-methylpiperazin-1-yl)methyl]-2,7-bis(oxidanyl)chromen-4-one Openeye Name: 3-(4-chlorophenyl)-2,7-dihydroxy-8-[(4-methylpiperazin-1-yl)methyl]chromen-4-one CAS Name: 3-(4-chlorophenyl)-2,7-dihydroxy-8-[(4-methyl-1-piperazinyl)methyl]-1-benzopyran-4-one IUPAC Name: 3-(4-chlorophenyl)-2,7-dihydroxy-8-[(4-methylpiperazin-1-yl)methyl]chromen-4-one Traditional Name: 3-(4-chlorophenyl)-2,7-dihydroxy-8-[(4-methylpiperazino)methyl]chromone Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=C(C=C4)Cl)O)O

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=C(C=C4)Cl)O)O

InChI

InChI=1S/C21H21ClN2O4/c1-23-8-10-24(11-9-23)12-16-17(25)7-6-15-19(26)18(21(27)28-20(15)16)13-2-4-14(22)5-3-13/h2-7,25,27H,8-12H2,1H3