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

Systemtic Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-[(3-nitrophenyl)methyl]azanium Openeye Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-[(3-nitrophenyl)methyl]ammonium CAS Name: [(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl-[(3-nitrophenyl)methyl]ammonium IUPAC Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-[(3-nitrophenyl)methyl]azanium Traditional Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-(3-nitrobenzyl)ammonium Formula: C14H23N3O2+2 MolecularWeight: 265.35132

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1C[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCC[C@H]1C[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O2/c1-2-16-8-4-7-14(16)11-15-10-12-5-3-6-13(9-12)17(18)19/h3,5-6,9,14-15H,2,4,7-8,10-11H2,1H3/p+2/t14-/m0/s1