2-(furan-2-yl)-6,7-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one

Systemtic Name: 2-(furan-2-yl)-6,7-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]chromen-4-one Openeye Name: 2-(2-furyl)-6,7-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]chromen-4-one CAS Name: 2-(2-furanyl)-6,7-dimethyl-3-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-1-benzopyran-4-one IUPAC Name: 2-(furan-2-yl)-6,7-dimethyl-3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]chromen-4-one Traditional Name: 2-(2-furyl)-3-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-6,7-dimethyl-chromone Formula: C22H25N2O5+ MolecularWeight: 397.4443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OCC(=O)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OCC(=O)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C22H24N2O5/c1-14-11-16-18(12-15(14)2)29-21(17-5-4-10-27-17)22(20(16)26)28-13-19(25)24-8-6-23(3)7-9-24/h4-5,10-12H,6-9,13H2,1-3H3/p+1