3-[[(4S)-2,2-dimethyl-4-(pyrrolidin-1-ium-1-ylmethyl)oxan-4-yl]methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4S)-2,2-dimethyl-4-(pyrrolidin-1-ium-1-ylmethyl)oxan-4-yl]methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(4S)-2,2-dimethyl-4-(pyrrolidin-1-ium-1-ylmethyl)tetrahydropyran-4-yl]methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(4S)-2,2-dimethyl-4-(1-pyrrolidin-1-iumylmethyl)-4-oxanyl]methylammonio]propyl-dimethylammonium IUPAC Name: 3-[[(4S)-2,2-dimethyl-4-(pyrrolidin-1-ium-1-ylmethyl)oxan-4-yl]methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(4S)-2,2-dimethyl-4-(pyrrolidin-1-ium-1-ylmethyl)tetrahydropyran-4-yl]methylammonio]propyl-dimethyl-ammonium Formula: C18H40N3O+3 MolecularWeight: 314.5297

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(C[NH2+]CCC[NH+](C)C)C[NH+]2CCCC2)C

Isomeric SMILES

CC1(C[C@@](CCO1)(C[NH2+]CCC[NH+](C)C)C[NH+]2CCCC2)C

InChI

InChI=1S/C18H37N3O/c1-17(2)14-18(8-13-22-17,16-21-11-5-6-12-21)15-19-9-7-10-20(3)4/h19H,5-16H2,1-4H3/p+3/t18-/m0/s1