(3S)-N-[(2S)-2-ethylhexyl]-1-(phenylmethyl)pyrrolidin-1-ium-3-amine

Systemtic Name: (3S)-N-[(2S)-2-ethylhexyl]-1-(phenylmethyl)pyrrolidin-1-ium-3-amine Openeye Name: (3S)-1-benzyl-N-[(2S)-2-ethylhexyl]pyrrolidin-1-ium-3-amine CAS Name: (3S)-N-[(2S)-2-ethylhexyl]-1-(phenylmethyl)-3-pyrrolidin-1-iumamine IUPAC Name: (3S)-1-benzyl-N-[(2S)-2-ethylhexyl]pyrrolidin-1-ium-3-amine Traditional Name: [(3S)-1-benzylpyrrolidin-1-ium-3-yl]-[(2S)-2-ethylhexyl]amine Formula: C19H33N2+ MolecularWeight: 289.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC1CC[NH+](C1)CC2=CC=CC=C2

Isomeric SMILES

CCCC[C@H](CC)CN[C@H]1CC[NH+](C1)CC2=CC=CC=C2

InChI

InChI=1S/C19H32N2/c1-3-5-9-17(4-2)14-20-19-12-13-21(16-19)15-18-10-7-6-8-11-18/h6-8,10-11,17,19-20H,3-5,9,12-16H2,1-2H3/p+1/t17-,19-/m0/s1