3,5-dimethyl-6-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]furo[3,2-g]chromen-7-one

Systemtic Name: 3,5-dimethyl-6-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]furo[3,2-g]chromen-7-one Openeye Name: 3,5-dimethyl-6-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]furo[3,2-g]chromen-7-one CAS Name: 3,5-dimethyl-6-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-7-furo[3,2-g][1]benzopyranone IUPAC Name: 3,5-dimethyl-6-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]furo[3,2-g]chromen-7-one Traditional Name: 6-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3,5-dimethyl-furo[3,2-g]chromen-7-one Formula: C20H23N2O4+ MolecularWeight: 355.40762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C20H22N2O4/c1-12-11-25-17-10-18-15(8-14(12)17)13(2)16(20(24)26-18)9-19(23)22-6-4-21(3)5-7-22/h8,10-11H,4-7,9H2,1-3H3/p+1