(2S,4R)-N-(3-bromophenyl)-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-N-(3-bromophenyl)-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-N-(3-bromophenyl)-4-hydroxy-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-N-(3-bromophenyl)-4-hydroxy-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-N-(3-bromophenyl)-4-hydroxypyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-N-(3-bromophenyl)-4-hydroxy-pyrrolidin-1-ium-2-carboxamide Formula: C11H14BrN2O2+ MolecularWeight: 286.14506

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C(=O)NC2=CC(=CC=C2)Br)O

Isomeric SMILES

C1[C@H](C[NH2+][C@@H]1C(=O)NC2=CC(=CC=C2)Br)O

InChI

InChI=1S/C11H13BrN2O2/c12-7-2-1-3-8(4-7)14-11(16)10-5-9(15)6-13-10/h1-4,9-10,13,15H,5-6H2,(H,14,16)/p+1/t9-,10+/m1/s1