[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-(3-methylbutyl)azanium

Systemtic Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-(3-methylbutyl)azanium Openeye Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-isopentyl-ammonium CAS Name: [(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl-(3-methylbutyl)ammonium IUPAC Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-(3-methylbutyl)azanium Traditional Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-isoamyl-ammonium Formula: C12H28N2+2 MolecularWeight: 200.36412

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1C[NH2+]CCC(C)C

Isomeric SMILES

CC[NH+]1CCC[C@H]1C[NH2+]CCC(C)C

InChI

InChI=1S/C12H26N2/c1-4-14-9-5-6-12(14)10-13-8-7-11(2)3/h11-13H,4-10H2,1-3H3/p+2/t12-/m0/s1