[(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-1-ium-4-yl)amino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-1-ium-4-yl)amino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(2-furyl)-2-[(1-propylpiperidin-1-ium-4-yl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(2-furanyl)-2-[(1-propyl-4-piperidin-1-iumyl)amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-1-ium-4-yl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(2-furyl)-2-[(1-propylpiperidin-1-ium-4-yl)amino]ethyl]-dimethyl-ammonium Formula: C16H31N3O+2 MolecularWeight: 281.43684

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCC(C2=CC=CO2)[NH+](C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC[C@@H](C2=CC=CO2)[NH+](C)C

InChI

InChI=1S/C16H29N3O/c1-4-9-19-10-7-14(8-11-19)17-13-15(18(2)3)16-6-5-12-20-16/h5-6,12,14-15,17H,4,7-11,13H2,1-3H3/p+2/t15-/m0/s1