(2S)-N-(4-aminophenyl)-2-pyrrolidin-1-ium-1-yl-propanamide

Systemtic Name: (2S)-N-(4-aminophenyl)-2-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(4-aminophenyl)-2-pyrrolidin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(4-aminophenyl)-2-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(4-aminophenyl)-2-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(4-aminophenyl)-2-pyrrolidin-1-ium-1-yl-propionamide Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O/c1-10(16-8-2-3-9-16)13(17)15-12-6-4-11(14)5-7-12/h4-7,10H,2-3,8-9,14H2,1H3,(H,15,17)/p+1/t10-/m0/s1