3-[[4-(dicyclohexylcarbamoyl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[4-(dicyclohexylcarbamoyl)phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[4-(dicyclohexylcarbamoyl)benzoyl]amino]benzoic acid CAS Name: 3-[[[4-[(dicyclohexylamino)-oxomethyl]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[4-(dicyclohexylcarbamoyl)benzoyl]amino]benzoic acid Traditional Name: 3-[[4-(dicyclohexylcarbamoyl)benzoyl]amino]benzoic acid Formula: C27H32N2O4 MolecularWeight: 448.55398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C27H32N2O4/c30-25(28-22-9-7-8-21(18-22)27(32)33)19-14-16-20(17-15-19)26(31)29(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h7-9,14-18,23-24H,1-6,10-13H2,(H,28,30)(H,32,33)