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

Systemtic Name: 3,5-dimethyl-6-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furo[3,2-g]chromen-7-one Openeye Name: 3,5-dimethyl-6-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furo[3,2-g]chromen-7-one CAS Name: 3,5-dimethyl-6-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-7-furo[3,2-g][1]benzopyranone IUPAC Name: 3,5-dimethyl-6-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furo[3,2-g]chromen-7-one Traditional Name: 6-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]-3,5-dimethyl-furo[3,2-g]chromen-7-one Formula: C24H24N3O4+ MolecularWeight: 418.46506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CCN(CC4)C5=CC=CC=[NH+]5)C

Isomeric SMILES

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CCN(CC4)C5=CC=CC=[NH+]5)C

InChI

InChI=1S/C24H23N3O4/c1-15-14-30-20-13-21-18(11-17(15)20)16(2)19(24(29)31-21)12-23(28)27-9-7-26(8-10-27)22-5-3-4-6-25-22/h3-6,11,13-14H,7-10,12H2,1-2H3/p+1