1-(2-chloranyl-5-nitro-phenyl)carbonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)carbonylpiperidine-2-carboxylic acid Openeye Name: 1-(2-chloro-5-nitro-benzoyl)piperidine-2-carboxylic acid CAS Name: 1-[(2-chloro-5-nitrophenyl)-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-(2-chloro-5-nitrobenzoyl)piperidine-2-carboxylic acid Traditional Name: 1-(2-chloro-5-nitro-benzoyl)pipecolinic acid Formula: C13H13ClN2O5 MolecularWeight: 312.70572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN2O5/c14-10-5-4-8(16(20)21)7-9(10)12(17)15-6-2-1-3-11(15)13(18)19/h4-5,7,11H,1-3,6H2,(H,18,19)