3-[(2-carboxy-5-phenyl-thiophen-3-yl)-(2,4-dichlorophenyl)carbonyl-amino]piperidine-1-carboxylic acid

Systemtic Name: 3-[(2-carboxy-5-phenyl-thiophen-3-yl)-(2,4-dichlorophenyl)carbonyl-amino]piperidine-1-carboxylic acid Openeye Name: 3-[(2-carboxy-5-phenyl-3-thienyl)-(2,4-dichlorobenzoyl)amino]piperidine-1-carboxylic acid CAS Name: 3-[(2-carboxy-5-phenyl-3-thiophenyl)-[(2,4-dichlorophenyl)-oxomethyl]amino]-1-piperidinecarboxylic acid IUPAC Name: 3-[(2-carboxy-5-phenylthiophen-3-yl)-(2,4-dichlorobenzoyl)amino]piperidine-1-carboxylic acid Traditional Name: 3-[(2-carboxy-5-phenyl-3-thienyl)-(2,4-dichlorobenzoyl)amino]piperidine-1-carboxylic acid Formula: C24H20Cl2N2O5S MolecularWeight: 519.397

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)O)N(C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)O)N(C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H20Cl2N2O5S/c25-15-8-9-17(18(26)11-15)22(29)28(16-7-4-10-27(13-16)24(32)33)19-12-20(34-21(19)23(30)31)14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,16H,4,7,10,13H2,(H,30,31)(H,32,33)