1-[(2-carboxy-4-chloranyl-phenyl)carbamoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-carboxy-4-chloranyl-phenyl)carbamoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2-carboxy-4-chloro-phenyl)carbamoyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-carboxy-4-chloroanilino)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-carboxy-4-chlorophenyl)carbamoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2-carboxy-4-chloro-phenyl)carbamoyl]isonipecotic acid Formula: C14H15ClN2O5 MolecularWeight: 326.7323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C14H15ClN2O5/c15-9-1-2-11(10(7-9)13(20)21)16-14(22)17-5-3-8(4-6-17)12(18)19/h1-2,7-8H,3-6H2,(H,16,22)(H,18,19)(H,20,21)