(2R)-1-(4-bromanyl-2-nitro-phenyl)piperidine-2-carboxylic acid

Systemtic Name: (2R)-1-(4-bromanyl-2-nitro-phenyl)piperidine-2-carboxylic acid Openeye Name: (2R)-1-(4-bromo-2-nitro-phenyl)piperidine-2-carboxylic acid CAS Name: (2R)-1-(4-bromo-2-nitrophenyl)-2-piperidinecarboxylic acid IUPAC Name: (2R)-1-(4-bromo-2-nitrophenyl)piperidine-2-carboxylic acid Traditional Name: (2R)-1-(4-bromo-2-nitro-phenyl)pipecolinic acid Formula: C12H13BrN2O4 MolecularWeight: 329.14662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN([C@H](C1)C(=O)O)C2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H13BrN2O4/c13-8-4-5-9(11(7-8)15(18)19)14-6-2-1-3-10(14)12(16)17/h4-5,7,10H,1-3,6H2,(H,16,17)/t10-/m1/s1