2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-[4-(4-hydroxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[4-(2-furoyl)piperazin-1-ium-1-yl]-1-[4-(4-hydroxyphenyl)piperazino]ethanone Formula: C21H27N4O4+ MolecularWeight: 399.46348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H26N4O4/c26-18-5-3-17(4-6-18)23-11-13-24(14-12-23)20(27)16-22-7-9-25(10-8-22)21(28)19-2-1-15-29-19/h1-6,15,26H,7-14,16H2/p+1