(2S)-1-[4-[4-[(2,4-dichlorophenyl)carbamoylamino]phenyl]phenyl]carbonylpiperidine-2-carboxylic acid

Systemtic Name: (2S)-1-[4-[4-[(2,4-dichlorophenyl)carbamoylamino]phenyl]phenyl]carbonylpiperidine-2-carboxylic acid Openeye Name: (2S)-1-[4-[4-[(2,4-dichlorophenyl)carbamoylamino]phenyl]benzoyl]piperidine-2-carboxylic acid CAS Name: (2S)-1-[[4-[4-[[(2,4-dichloroanilino)-oxomethyl]amino]phenyl]phenyl]-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: (2S)-1-[4-[4-[(2,4-dichlorophenyl)carbamoylamino]phenyl]benzoyl]piperidine-2-carboxylic acid Traditional Name: (2S)-1-[4-[4-[(2,4-dichlorophenyl)carbamoylamino]phenyl]benzoyl]pipecolinic acid Formula: C26H23Cl2N3O4 MolecularWeight: 512.38452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)NC(=O)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)NC(=O)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H23Cl2N3O4/c27-19-10-13-22(21(28)15-19)30-26(35)29-20-11-8-17(9-12-20)16-4-6-18(7-5-16)24(32)31-14-2-1-3-23(31)25(33)34/h4-13,15,23H,1-3,14H2,(H,33,34)(H2,29,30,35)/t23-/m0/s1