[2-ethyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]butyl]azanium

Systemtic Name: [2-ethyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]butyl]azanium Openeye Name: [2-ethyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]butyl]ammonium CAS Name: [2-ethyl-2-[(3S)-3-methyl-1-piperidin-1-iumyl]butyl]ammonium IUPAC Name: [2-ethyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]butyl]azanium Traditional Name: [2-ethyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]butyl]ammonium Formula: C12H28N2+2 MolecularWeight: 200.36412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C[NH3+])[NH+]1CCCC(C1)C

Isomeric SMILES

CCC(CC)(C[NH3+])[NH+]1CCC[C@@H](C1)C

InChI

InChI=1S/C12H26N2/c1-4-12(5-2,10-13)14-8-6-7-11(3)9-14/h11H,4-10,13H2,1-3H3/p+2/t11-/m0/s1