(3S)-N-(3-chloranyl-4-fluoranyl-phenyl)-1-(phenylmethyl)pyrrolidin-1-ium-3-amine

Systemtic Name: (3S)-N-(3-chloranyl-4-fluoranyl-phenyl)-1-(phenylmethyl)pyrrolidin-1-ium-3-amine Openeye Name: (3S)-1-benzyl-N-(3-chloro-4-fluoro-phenyl)pyrrolidin-1-ium-3-amine CAS Name: (3S)-N-(3-chloro-4-fluorophenyl)-1-(phenylmethyl)-3-pyrrolidin-1-iumamine IUPAC Name: (3S)-1-benzyl-N-(3-chloro-4-fluorophenyl)pyrrolidin-1-ium-3-amine Traditional Name: [(3S)-1-benzylpyrrolidin-1-ium-3-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C17H19ClFN2+ MolecularWeight: 305.797563

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC2=CC(=C(C=C2)F)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1NC2=CC(=C(C=C2)F)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C17H18ClFN2/c18-16-10-14(6-7-17(16)19)20-15-8-9-21(12-15)11-13-4-2-1-3-5-13/h1-7,10,15,20H,8-9,11-12H2/p+1/t15-/m0/s1