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

Systemtic Name: 2,3,5-trimethyl-6-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furo[3,2-g]chromen-7-one Openeye Name: 2,3,5-trimethyl-6-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]furo[3,2-g]chromen-7-one CAS Name: 2,3,5-trimethyl-6-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-7-furo[3,2-g][1]benzopyranone IUPAC Name: 2,3,5-trimethyl-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]-2,3,5-trimethyl-furo[3,2-g]chromen-7-one Formula: C25H26N3O4+ MolecularWeight: 432.49164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CC(=O)N4CCN(CC4)C5=CC=CC=[NH+]5)C)C

Isomeric SMILES

CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CC(=O)N4CCN(CC4)C5=CC=CC=[NH+]5)C)C

InChI

InChI=1S/C25H25N3O4/c1-15-17(3)31-21-14-22-19(12-18(15)21)16(2)20(25(30)32-22)13-24(29)28-10-8-27(9-11-28)23-6-4-5-7-26-23/h4-7,12,14H,8-11,13H2,1-3H3/p+1