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

Systemtic Name: 4-(4-methoxyphenyl)-7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]chromen-2-one Openeye Name: 4-(4-methoxyphenyl)-7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]chromen-2-one CAS Name: 4-(4-methoxyphenyl)-7-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 4-(4-methoxyphenyl)-7-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]chromen-2-one Traditional Name: 7-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-4-(4-methoxyphenyl)coumarin Formula: C23H25N2O5+ MolecularWeight: 409.455

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=C(C=C4)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H24N2O5/c1-24-9-11-25(12-10-24)22(26)15-29-18-7-8-19-20(14-23(27)30-21(19)13-18)16-3-5-17(28-2)6-4-16/h3-8,13-14H,9-12,15H2,1-2H3/p+1