7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]-5-oxidanyl-2-phenyl-chromen-4-one

Systemtic Name: 7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]-5-oxidanyl-2-phenyl-chromen-4-one Openeye Name: 5-hydroxy-7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]-2-phenyl-chromen-4-one CAS Name: 5-hydroxy-7-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-2-phenyl-1-benzopyran-4-one IUPAC Name: 5-hydroxy-7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]-2-phenylchromen-4-one Traditional Name: 5-hydroxy-7-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-2-phenyl-chromone Formula: C22H23N2O5+ MolecularWeight: 395.42842

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)COC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)COC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C22H22N2O5/c1-23-7-9-24(10-8-23)21(27)14-28-16-11-17(25)22-18(26)13-19(29-20(22)12-16)15-5-3-2-4-6-15/h2-6,11-13,25H,7-10,14H2,1H3/p+1