1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]pentan-1-one

Systemtic Name: 1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]pentan-1-one Openeye Name: 1-[4-(2-furylmethyl)piperazin-4-ium-1-yl]pentan-1-one CAS Name: 1-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]-1-pentanone IUPAC Name: 1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]pentan-1-one Traditional Name: 1-[4-(2-furfuryl)piperazin-4-ium-1-yl]pentan-1-one Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CC[NH+](CC1)CC2=CC=CO2

Isomeric SMILES

CCCCC(=O)N1CC[NH+](CC1)CC2=CC=CO2

InChI

InChI=1S/C14H22N2O2/c1-2-3-6-14(17)16-9-7-15(8-10-16)12-13-5-4-11-18-13/h4-5,11H,2-3,6-10,12H2,1H3/p+1