5-bromanyl-2-chloranyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-5-bromo-2-chloro-benzamide CAS Name: 5-bromo-2-chloro-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-5-bromo-2-chlorobenzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-5-bromo-2-chloro-benzamide Formula: C18H19BrClN2O+ MolecularWeight: 394.71326

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)C2=C(C=CC(=C2)Br)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1NC(=O)C2=C(C=CC(=C2)Br)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H18BrClN2O/c19-14-6-7-17(20)16(10-14)18(23)21-15-8-9-22(12-15)11-13-4-2-1-3-5-13/h1-7,10,15H,8-9,11-12H2,(H,21,23)/p+1/t15-/m0/s1