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

Systemtic Name: (2S)-N-(3-aminophenyl)-2-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(3-aminophenyl)-2-pyrrolidin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(3-aminophenyl)-2-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(3-aminophenyl)-2-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(3-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=CC(=C1)N)[NH+]2CCCC2

Isomeric SMILES

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

InChI

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