7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)-8-methyl-chromen-4-one

Systemtic Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)-8-methyl-chromen-4-one Openeye Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)-8-methyl-chromen-4-one CAS Name: 7-[2-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]ethoxy]-3-(4-methoxyphenyl)-8-methyl-1-benzopyran-4-one IUPAC Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)-8-methylchromen-4-one Traditional Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)-8-methyl-chromone Formula: C25H31N2O5+ MolecularWeight: 439.52404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=C(C=C3)OC)OCC[NH+]4CCN(CC4)CCO

Isomeric SMILES

CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=C(C=C3)OC)OCC[NH+]4CCN(CC4)CCO

InChI

InChI=1S/C25H30N2O5/c1-18-23(31-16-14-27-11-9-26(10-12-27)13-15-28)8-7-21-24(29)22(17-32-25(18)21)19-3-5-20(30-2)6-4-19/h3-8,17,28H,9-16H2,1-2H3/p+1