2-[[2-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[2-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[2-[(3-chloro-4-fluoro-phenyl)carbamoyl]phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[2-[(3-chloro-4-fluoroanilino)-oxomethyl]anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[2-[(3-chloro-4-fluorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[2-[(3-chloro-4-fluoro-phenyl)carbamoyl]phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C21H20ClFN2O4 MolecularWeight: 418.845903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)O

Isomeric SMILES

C1CCC(C(C1)C(=O)NC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)O

InChI

InChI=1S/C21H20ClFN2O4/c22-16-11-12(9-10-17(16)23)24-20(27)15-7-3-4-8-18(15)25-19(26)13-5-1-2-6-14(13)21(28)29/h3-4,7-11,13-14H,1-2,5-6H2,(H,24,27)(H,25,26)(H,28,29)