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

Systemtic Name: 7-methyl-2-(4-methylphenyl)-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one Openeye Name: 7-methyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]-2-(p-tolyl)chromen-4-one CAS Name: 7-methyl-2-(4-methylphenyl)-3-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-1-benzopyran-4-one IUPAC Name: 7-methyl-2-(4-methylphenyl)-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]chromen-4-one Traditional Name: 3-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-7-methyl-2-(p-tolyl)chromone Formula: C24H27N2O4+ MolecularWeight: 407.48218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)C)OCC(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)C)OCC(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C24H26N2O4/c1-16-4-7-18(8-5-16)23-24(22(28)19-9-6-17(2)14-20(19)30-23)29-15-21(27)26-12-10-25(3)11-13-26/h4-9,14H,10-13,15H2,1-3H3/p+1