(2S)-N-(2-chloranylpyridin-3-yl)-2-pyrrolidin-1-ium-1-yl-propanamide

Systemtic Name: (2S)-N-(2-chloranylpyridin-3-yl)-2-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(2-chloro-3-pyridyl)-2-pyrrolidin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(2-chloro-3-pyridinyl)-2-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(2-chloropyridin-3-yl)-2-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(2-chloro-3-pyridyl)-2-pyrrolidin-1-ium-1-yl-propionamide Formula: C12H17ClN3O+ MolecularWeight: 254.73588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(N=CC=C1)Cl)[NH+]2CCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(N=CC=C1)Cl)[NH+]2CCCC2

InChI

InChI=1S/C12H16ClN3O/c1-9(16-7-2-3-8-16)12(17)15-10-5-4-6-14-11(10)13/h4-6,9H,2-3,7-8H2,1H3,(H,15,17)/p+1/t9-/m0/s1