3-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzamide

Systemtic Name: 3-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzamide Openeye Name: 3-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzamide CAS Name: 3-cyano-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]benzamide IUPAC Name: 3-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzamide Traditional Name: 3-cyano-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzamide Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O/c1-2-18-8-4-7-14(18)11-17-15(19)13-6-3-5-12(9-13)10-16/h3,5-6,9,14H,2,4,7-8,11H2,1H3,(H,17,19)/p+1/t14-/m0/s1