1-(2-adamantyl)-3-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]urea

Systemtic Name: 1-(2-adamantyl)-3-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]urea Openeye Name: 1-(2-adamantyl)-3-(3,5-dichloro-4-hydroxy-phenyl)urea CAS Name: 1-(2-adamantyl)-3-(3,5-dichloro-4-hydroxyphenyl)urea IUPAC Name: 1-(2-adamantyl)-3-(3,5-dichloro-4-hydroxyphenyl)urea Traditional Name: 1-(2-adamantyl)-3-(3,5-dichloro-4-hydroxy-phenyl)urea Formula: C17H20Cl2N2O2 MolecularWeight: 355.2589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)NC4=CC(=C(C(=C4)Cl)O)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)NC4=CC(=C(C(=C4)Cl)O)Cl

InChI

InChI=1S/C17H20Cl2N2O2/c18-13-6-12(7-14(19)16(13)22)20-17(23)21-15-10-2-8-1-9(4-10)5-11(15)3-8/h6-11,15,22H,1-5H2,(H2,20,21,23)