3-chloranyl-4-(cyclododecylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(cyclododecylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione Openeye Name: 3-chloro-4-(cyclododecylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione CAS Name: 3-chloro-4-(cyclododecylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-4-(cyclododecylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione Traditional Name: 3-chloro-4-(cyclododecylamino)-1-(2-fluorophenyl)-3-pyrroline-2,5-quinone Formula: C22H28ClFN2O2 MolecularWeight: 406.921323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3F)Cl

Isomeric SMILES

C1CCCCCC(CCCCC1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C22H28ClFN2O2/c23-19-20(22(28)26(21(19)27)18-15-11-10-14-17(18)24)25-16-12-8-6-4-2-1-3-5-7-9-13-16/h10-11,14-16,25H,1-9,12-13H2