[1-[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-yl]carbonylpiperidin-4-yl]azanium

Systemtic Name: [1-[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-yl]carbonylpiperidin-4-yl]azanium Openeye Name: [1-[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-carbonyl]-4-piperidyl]ammonium CAS Name: [1-[[5-methyl-4-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-2-furanyl]-oxomethyl]-4-piperidinyl]ammonium IUPAC Name: [1-[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]furan-2-carbonyl]piperidin-4-yl]azanium Traditional Name: [1-[5-methyl-4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-furoyl]-4-piperidyl]ammonium Formula: C18H31N3O2+2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(OC(=C2)C(=O)N3CCC(CC3)[NH3+])C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(OC(=C2)C(=O)N3CCC(CC3)[NH3+])C

InChI

InChI=1S/C18H29N3O2/c1-13-5-3-4-8-21(13)12-15-11-17(23-14(15)2)18(22)20-9-6-16(19)7-10-20/h11,13,16H,3-10,12,19H2,1-2H3/p+2/t13-/m0/s1