1-aminocarbonyl-2-[2-[[2,6-bis(chloranyl)phenyl]carbonylamino]phenyl]-2-ethyl-piperidine-4-carboxylic acid

Systemtic Name: 1-aminocarbonyl-2-[2-[[2,6-bis(chloranyl)phenyl]carbonylamino]phenyl]-2-ethyl-piperidine-4-carboxylic acid Openeye Name: 1-carbamoyl-2-[2-[(2,6-dichlorobenzoyl)amino]phenyl]-2-ethyl-piperidine-4-carboxylic acid CAS Name: 1-carbamoyl-2-[2-[[(2,6-dichlorophenyl)-oxomethyl]amino]phenyl]-2-ethyl-4-piperidinecarboxylic acid IUPAC Name: 1-carbamoyl-2-[2-[(2,6-dichlorobenzoyl)amino]phenyl]-2-ethylpiperidine-4-carboxylic acid Traditional Name: 1-carbamoyl-2-[2-[(2,6-dichlorobenzoyl)amino]phenyl]-2-ethyl-isonipecotic acid Formula: C22H23Cl2N3O4 MolecularWeight: 464.34172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCN1C(=O)N)C(=O)O)C2=CC=CC=C2NC(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CCC1(CC(CCN1C(=O)N)C(=O)O)C2=CC=CC=C2NC(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C22H23Cl2N3O4/c1-2-22(12-13(20(29)30)10-11-27(22)21(25)31)14-6-3-4-9-17(14)26-19(28)18-15(23)7-5-8-16(18)24/h3-9,13H,2,10-12H2,1H3,(H2,25,31)(H,26,28)(H,29,30)