3-[[5-[(4-cyclohexylcyclohexyl)-[[4-(trifluoromethyloxy)phenyl]carbamoyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-[(4-cyclohexylcyclohexyl)-[[4-(trifluoromethyloxy)phenyl]carbamoyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-[(4-cyclohexylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoyl]amino]tetralin-6-carbonyl]amino]propanoic acid CAS Name: 3-[[[5-[(4-cyclohexylcyclohexyl)-[oxo-[4-(trifluoromethoxy)anilino]methyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-[(4-cyclohexylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoyl]amino]-5,6,7,8-tetrahydronaphthalene-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-[(4-cyclohexylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoyl]amino]tetralin-6-carbonyl]amino]propionic acid Formula: C34H42F3N3O5 MolecularWeight: 629.70959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CCC(CC2)N(C3CCCC4=C3C=CC(=C4)C(=O)NCCC(=O)O)C(=O)NC5=CC=C(C=C5)OC(F)(F)F

Isomeric SMILES

C1CCC(CC1)C2CCC(CC2)N(C3CCCC4=C3C=CC(=C4)C(=O)NCCC(=O)O)C(=O)NC5=CC=C(C=C5)OC(F)(F)F

InChI

InChI=1S/C34H42F3N3O5/c35-34(36,37)45-28-16-12-26(13-17-28)39-33(44)40(27-14-9-23(10-15-27)22-5-2-1-3-6-22)30-8-4-7-24-21-25(11-18-29(24)30)32(43)38-20-19-31(41)42/h11-13,16-18,21-23,27,30H,1-10,14-15,19-20H2,(H,38,43)(H,39,44)(H,41,42)