(2R,4R)-4-[(4-bromanyl-1H-pyrrol-2-yl)carbonyloxy]piperidine-2-carboxylic acid

Systemtic Name: (2R,4R)-4-[(4-bromanyl-1H-pyrrol-2-yl)carbonyloxy]piperidine-2-carboxylic acid Openeye Name: (2R,4R)-4-(4-bromo-1H-pyrrole-2-carbonyl)oxypiperidine-2-carboxylic acid CAS Name: (2R,4R)-4-[(4-bromo-1H-pyrrol-2-yl)-oxomethoxy]-2-piperidinecarboxylic acid IUPAC Name: (2R,4R)-4-(4-bromo-1H-pyrrole-2-carbonyl)oxypiperidine-2-carboxylic acid Traditional Name: (2R,4R)-4-(4-bromo-1H-pyrrole-2-carbonyl)oxypipecolinic acid Formula: C11H13BrN2O4 MolecularWeight: 317.13592

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(CC1OC(=O)C2=CC(=CN2)Br)C(=O)O

Isomeric SMILES

C1CN[C@H](C[C@@H]1OC(=O)C2=CC(=CN2)Br)C(=O)O

InChI

InChI=1S/C11H13BrN2O4/c12-6-3-9(14-5-6)11(17)18-7-1-2-13-8(4-7)10(15)16/h3,5,7-8,13-14H,1-2,4H2,(H,15,16)/t7-,8-/m1/s1