N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-3-(1-pyrrolidin-1-iumyl)-1-propanamine IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-3-pyrrolidin-1-ium-1-ylpropan-1-amine Traditional Name: (5-bromo-2-fluoro-benzyl)-(3-pyrrolidin-1-ium-1-ylpropyl)amine Formula: C14H21BrFN2+ MolecularWeight: 316.232343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1CC[NH+](C1)CCCNCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C14H20BrFN2/c15-13-4-5-14(16)12(10-13)11-17-6-3-9-18-7-1-2-8-18/h4-5,10,17H,1-3,6-9,11H2/p+1