(2S)-2-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-propan-2-yl-propanamide

Systemtic Name: (2S)-2-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-propan-2-yl-propanamide Openeye Name: (2S)-2-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-isopropyl-propanamide CAS Name: (2S)-2-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-N-propan-2-ylpropanamide IUPAC Name: (2S)-2-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-propan-2-ylpropanamide Traditional Name: (2S)-2-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-isopropyl-propionamide Formula: C13H28N3O+ MolecularWeight: 242.38092

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(C)C(=O)NC(C)C

Isomeric SMILES

CC[NH+]1CCC[C@H]1CN[C@@H](C)C(=O)NC(C)C

InChI

InChI=1S/C13H27N3O/c1-5-16-8-6-7-12(16)9-14-11(4)13(17)15-10(2)3/h10-12,14H,5-9H2,1-4H3,(H,15,17)/p+1/t11-,12-/m0/s1