1-[(1R)-1-(5-piperazin-4-ium-1-ylcarbonylfuran-2-yl)ethyl]piperidin-1-ium-4-one

Systemtic Name: 1-[(1R)-1-(5-piperazin-4-ium-1-ylcarbonylfuran-2-yl)ethyl]piperidin-1-ium-4-one Openeye Name: 1-[(1R)-1-[5-(piperazin-4-ium-1-carbonyl)-2-furyl]ethyl]piperidin-1-ium-4-one CAS Name: 1-[(1R)-1-[5-[oxo(1-piperazin-4-iumyl)methyl]-2-furanyl]ethyl]-4-piperidin-1-iumone IUPAC Name: 1-[(1R)-1-[5-(piperazin-4-ium-1-carbonyl)furan-2-yl]ethyl]piperidin-1-ium-4-one Traditional Name: 1-[(1R)-1-[5-(piperazin-4-ium-1-carbonyl)-2-furyl]ethyl]piperidin-1-ium-4-one Formula: C16H25N3O3+2 MolecularWeight: 307.388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(O1)C(=O)N2CC[NH2+]CC2)[NH+]3CCC(=O)CC3

Isomeric SMILES

C[C@H](C1=CC=C(O1)C(=O)N2CC[NH2+]CC2)[NH+]3CCC(=O)CC3

InChI

InChI=1S/C16H23N3O3/c1-12(18-8-4-13(20)5-9-18)14-2-3-15(22-14)16(21)19-10-6-17-7-11-19/h2-3,12,17H,4-11H2,1H3/p+2/t12-/m1/s1