1-[4-[(5-piperazin-4-ium-1-ylcarbonylfuran-2-yl)methoxy]phenyl]ethanone

Systemtic Name: 1-[4-[(5-piperazin-4-ium-1-ylcarbonylfuran-2-yl)methoxy]phenyl]ethanone Openeye Name: 1-[4-[[5-(piperazin-4-ium-1-carbonyl)-2-furyl]methoxy]phenyl]ethanone CAS Name: 1-[4-[[5-[oxo(1-piperazin-4-iumyl)methyl]-2-furanyl]methoxy]phenyl]ethanone IUPAC Name: 1-[4-[[5-(piperazin-4-ium-1-carbonyl)furan-2-yl]methoxy]phenyl]ethanone Traditional Name: 1-[4-[[5-(piperazin-4-ium-1-carbonyl)-2-furyl]methoxy]phenyl]ethanone Formula: C18H21N2O4+ MolecularWeight: 329.37034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C18H20N2O4/c1-13(21)14-2-4-15(5-3-14)23-12-16-6-7-17(24-16)18(22)20-10-8-19-9-11-20/h2-7,19H,8-12H2,1H3/p+1