8-[(4-methylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-4-(2-oxidanylidenechromen-3-yl)chromen-2-one

Systemtic Name: 8-[(4-methylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-4-(2-oxidanylidenechromen-3-yl)chromen-2-one Openeye Name: 7-hydroxy-8-[(4-methylpiperazin-4-ium-1-yl)methyl]-4-(2-oxochromen-3-yl)chromen-2-one CAS Name: 7-hydroxy-8-[(4-methyl-1-piperazin-4-iumyl)methyl]-4-(2-oxo-1-benzopyran-3-yl)-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-[(4-methylpiperazin-4-ium-1-yl)methyl]-4-(2-oxochromen-3-yl)chromen-2-one Traditional Name: 7-hydroxy-4-(2-ketochromen-3-yl)-8-[(4-methylpiperazin-4-ium-1-yl)methyl]coumarin Formula: C24H23N2O5+ MolecularWeight: 419.44982

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=CC=CC=C5OC4=O)O

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=CC=CC=C5OC4=O)O

InChI

InChI=1S/C24H22N2O5/c1-25-8-10-26(11-9-25)14-19-20(27)7-6-16-17(13-22(28)31-23(16)19)18-12-15-4-2-3-5-21(15)30-24(18)29/h2-7,12-13,27H,8-11,14H2,1H3/p+1