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

Systemtic Name: 7-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one Openeye Name: 7-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-2-oxo-ethoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one CAS Name: 7-[2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-2-oxoethoxy]-3-(4-methoxyphenyl)-2-methyl-1-benzopyran-4-one IUPAC Name: 7-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-2-oxoethoxy]-3-(4-methoxyphenyl)-2-methylchromen-4-one Traditional Name: 7-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-2-keto-ethoxy]-3-(4-methoxyphenyl)-2-methyl-chromone Formula: C25H29N2O6+ MolecularWeight: 453.50756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CC[NH+](CC3)CCO)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CC[NH+](CC3)CCO)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H28N2O6/c1-17-24(18-3-5-19(31-2)6-4-18)25(30)21-8-7-20(15-22(21)33-17)32-16-23(29)27-11-9-26(10-12-27)13-14-28/h3-8,15,28H,9-14,16H2,1-2H3/p+1