(2S)-1-(5-bromanyl-2-nitro-phenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(5-bromanyl-2-nitro-phenyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(5-bromo-2-nitro-phenyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-(5-bromo-2-nitrophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(5-bromo-2-nitrophenyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(5-bromo-2-nitro-phenyl)proline Formula: C11H11BrN2O4 MolecularWeight: 315.12004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrN2O4/c12-7-3-4-8(14(17)18)10(6-7)13-5-1-2-9(13)11(15)16/h3-4,6,9H,1-2,5H2,(H,15,16)/t9-/m0/s1