[(2S)-1-(4-bromophenyl)carbonylpyrrolidin-2-yl]methylazanium

Systemtic Name: [(2S)-1-(4-bromophenyl)carbonylpyrrolidin-2-yl]methylazanium Openeye Name: [(2S)-1-(4-bromobenzoyl)pyrrolidin-2-yl]methylammonium CAS Name: [(2S)-1-[(4-bromophenyl)-oxomethyl]-2-pyrrolidinyl]methylammonium IUPAC Name: [(2S)-1-(4-bromobenzoyl)pyrrolidin-2-yl]methylazanium Traditional Name: [(2S)-1-(4-bromobenzoyl)pyrrolidin-2-yl]methylammonium Formula: C12H16BrN2O+ MolecularWeight: 284.17224

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=C(C=C2)Br)C[NH3+]

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=C(C=C2)Br)C[NH3+]

InChI

InChI=1S/C12H15BrN2O/c13-10-5-3-9(4-6-10)12(16)15-7-1-2-11(15)8-14/h3-6,11H,1-2,7-8,14H2/p+1/t11-/m0/s1