1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(2-nitrophenyl)methyl]methanamine

Systemtic Name: 1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(2-nitrophenyl)methyl]methanamine Openeye Name: 1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(2-nitrophenyl)methyl]methanamine CAS Name: 1-[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]-N-[(2-nitrophenyl)methyl]methanamine IUPAC Name: 1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(2-nitrophenyl)methyl]methanamine Traditional Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-(2-nitrobenzyl)amine Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O2/c1-2-16-9-5-7-13(16)11-15-10-12-6-3-4-8-14(12)17(18)19/h3-4,6,8,13,15H,2,5,7,9-11H2,1H3/p+1/t13-/m0/s1