N-(5-chloranyl-2-cyano-phenyl)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]acetamide Formula: C16H22ClN4O+ MolecularWeight: 321.82508

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNCC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNCC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C16H21ClN4O/c1-2-21-7-3-4-14(21)10-19-11-16(22)20-15-8-13(17)6-5-12(15)9-18/h5-6,8,14,19H,2-4,7,10-11H2,1H3,(H,20,22)/p+1/t14-/m1/s1