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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

C1CN(CCC1N(C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl)C(=O)O

InChI

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