2-(3,4-dimethoxyphenyl)-6,8-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-6,8-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one Openeye Name: 2-(3,4-dimethoxyphenyl)-6,8-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]chromen-4-one CAS Name: 2-(3,4-dimethoxyphenyl)-6,8-dimethyl-3-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-1-benzopyran-4-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-6,8-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]chromen-4-one Traditional Name: 2-(3,4-dimethoxyphenyl)-3-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-6,8-dimethyl-chromone Formula: C26H31N2O6+ MolecularWeight: 467.53414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OCC(=O)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OCC(=O)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C26H30N2O6/c1-16-12-17(2)24-19(13-16)23(30)26(33-15-22(29)28-10-8-27(3)9-11-28)25(34-24)18-6-7-20(31-4)21(14-18)32-5/h6-7,12-14H,8-11,15H2,1-5H3/p+1