[(2S)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-4-methyl-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-4-methyl-pentan-2-yl]azanium Openeye Name: [(1S)-1-[[4-(2-furylmethyl)piperazin-4-ium-1-yl]methyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]-4-methylpentan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-4-methylpentan-2-yl]azanium Traditional Name: [(1S)-1-[[4-(2-furfuryl)piperazin-4-ium-1-yl]methyl]-3-methyl-butyl]ammonium Formula: C15H29N3O+2 MolecularWeight: 267.41026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1CC[NH+](CC1)CC2=CC=CO2)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](CN1CC[NH+](CC1)CC2=CC=CO2)[NH3+]

InChI

InChI=1S/C15H27N3O/c1-13(2)10-14(16)11-17-5-7-18(8-6-17)12-15-4-3-9-19-15/h3-4,9,13-14H,5-8,10-12,16H2,1-2H3/p+2/t14-/m0/s1