N-(2-azanyl-4-fluoranyl-phenyl)-3-pyrrolidin-1-ium-1-yl-propanamide

Systemtic Name: N-(2-azanyl-4-fluoranyl-phenyl)-3-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: N-(2-amino-4-fluoro-phenyl)-3-pyrrolidin-1-ium-1-yl-propanamide CAS Name: N-(2-amino-4-fluorophenyl)-3-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: N-(2-amino-4-fluorophenyl)-3-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: N-(2-amino-4-fluoro-phenyl)-3-pyrrolidin-1-ium-1-yl-propionamide Formula: C13H19FN3O+ MolecularWeight: 252.307863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC(=O)NC2=C(C=C(C=C2)F)N

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=C(C=C(C=C2)F)N

InChI

InChI=1S/C13H18FN3O/c14-10-3-4-12(11(15)9-10)16-13(18)5-8-17-6-1-2-7-17/h3-4,9H,1-2,5-8,15H2,(H,16,18)/p+1