3-aminocarbonyl-1,1-dimethyl-urea; 1-aminocarbonylurea; 1,2,3,4-tetrakis(chloranyl)perylene

Systemtic Name: 3-aminocarbonyl-1,1-dimethyl-urea; 1-aminocarbonylurea; 1,2,3,4-tetrakis(chloranyl)perylene Openeye Name: 3-carbamoyl-1,1-dimethyl-urea; carbamoylurea; 1,2,3,4-tetrachloroperylene CAS Name: 3-carbamoyl-1,1-dimethylurea; carbamoylurea; 1,2,3,4-tetrachloroperylene IUPAC Name: 3-carbamoyl-1,1-dimethylurea; carbamoylurea; 1,2,3,4-tetrachloroperylene Traditional Name: 3-carbamoyl-1,1-dimethyl-urea; carbamoylurea; 1,2,3,4-tetrachloroperylene Formula: C26H22Cl4N6O4 MolecularWeight: 624.30268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC(=O)N.C1=CC2=C3C(=C1)C4=C5C(=C(C=C4)Cl)C(=C(C(=C5C3=CC=C2)Cl)Cl)Cl.C(=O)(N)NC(=O)N

Isomeric SMILES

CN(C)C(=O)NC(=O)N.C1=CC2=C3C(=C1)C4=C5C(=C(C=C4)Cl)C(=C(C(=C5C3=CC=C2)Cl)Cl)Cl.C(=O)(N)NC(=O)N

InChI

InChI=1S/C20H8Cl4.C4H9N3O2.C2H5N3O2/c21-13-8-7-11-10-5-1-3-9-4-2-6-12(14(9)10)16-15(11)17(13)19(23)20(24)18(16)22;1-7(2)4(9)6-3(5)8;3-1(6)5-2(4)7/h1-8H;1-2H3,(H3,5,6,8,9);(H5,3,4,5,6,7)