2-(3,4-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one Openeye Name: 2-(3,4-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxo-ethoxy]chromen-4-one CAS Name: 2-(3,4-dimethoxyphenyl)-7-methyl-3-[2-(4-methyl-1-piperazinyl)-2-oxoethoxy]-1-benzopyran-4-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethoxy]chromen-4-one Traditional Name: 2-(3,4-dimethoxyphenyl)-3-[2-keto-2-(4-methylpiperazino)ethoxy]-7-methyl-chromone Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OCC(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OCC(=O)N4CCN(CC4)C

InChI

InChI=1S/C25H28N2O6/c1-16-5-7-18-20(13-16)33-24(17-6-8-19(30-3)21(14-17)31-4)25(23(18)29)32-15-22(28)27-11-9-26(2)10-12-27/h5-8,13-14H,9-12,15H2,1-4H3