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

Systemtic Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)chromen-4-one Openeye Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)chromen-4-one CAS Name: 7-[2-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]ethoxy]-3-(4-methoxyphenyl)-1-benzopyran-4-one IUPAC Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)chromen-4-one Traditional Name: 7-[2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethoxy]-3-(4-methoxyphenyl)chromone Formula: C24H29N2O5+ MolecularWeight: 425.49746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC[NH+]4CCN(CC4)CCO

Isomeric SMILES

COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC[NH+]4CCN(CC4)CCO

InChI

InChI=1S/C24H28N2O5/c1-29-19-4-2-18(3-5-19)22-17-31-23-16-20(6-7-21(23)24(22)28)30-15-13-26-10-8-25(9-11-26)12-14-27/h2-7,16-17,27H,8-15H2,1H3/p+1