[(3S,4R)-3-(3-methoxy-3-oxidanylidene-propyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]-dimethyl-azanium

Systemtic Name: [(3S,4R)-3-(3-methoxy-3-oxidanylidene-propyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]-dimethyl-azanium Openeye Name: [(3S,4R)-3-(3-methoxy-3-oxo-propyl)-1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]-dimethyl-ammonium CAS Name: [(3S,4R)-3-(3-methoxy-3-oxopropyl)-1-(1-methyl-4-piperidin-1-iumyl)-4-piperidinyl]-dimethylammonium IUPAC Name: [(3S,4R)-3-(3-methoxy-3-oxopropyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]-dimethylazanium Traditional Name: [(3S,4R)-3-(3-keto-3-methoxy-propyl)-1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]-dimethyl-ammonium Formula: C17H35N3O2+2 MolecularWeight: 313.4787

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCC(C(C2)CCC(=O)OC)[NH+](C)C

Isomeric SMILES

C[NH+]1CCC(CC1)N2CC[C@H]([C@H](C2)CCC(=O)OC)[NH+](C)C

InChI

InChI=1S/C17H33N3O2/c1-18(2)16-9-12-20(15-7-10-19(3)11-8-15)13-14(16)5-6-17(21)22-4/h14-16H,5-13H2,1-4H3/p+2/t14-,16+/m0/s1