[(1S)-1-(5-methylfuran-2-yl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(5-methylfuran-2-yl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-1-(5-methyl-2-furyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-1-(5-methyl-2-furanyl)ethyl]-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(5-methylfuran-2-yl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-1-(5-methyl-2-furyl)ethyl]-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C15H28N2O+2 MolecularWeight: 252.39562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

CC1=CC=C(O1)[C@H](C)[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C15H26N2O/c1-13-7-8-15(18-13)14(2)16-9-6-12-17-10-4-3-5-11-17/h7-8,14,16H,3-6,9-12H2,1-2H3/p+2/t14-/m0/s1