1-(2-methyl-1-oxidanyl-propan-2-yl)-3-[3-(4-methylphenyl)-1-adamantyl]urea

Systemtic Name: 1-(2-methyl-1-oxidanyl-propan-2-yl)-3-[3-(4-methylphenyl)-1-adamantyl]urea Openeye Name: 1-(2-hydroxy-1,1-dimethyl-ethyl)-3-[3-(p-tolyl)-1-adamantyl]urea CAS Name: 1-(1-hydroxy-2-methylpropan-2-yl)-3-[3-(4-methylphenyl)-1-adamantyl]urea IUPAC Name: 1-(1-hydroxy-2-methylpropan-2-yl)-3-[3-(4-methylphenyl)-1-adamantyl]urea Traditional Name: 1-(2-hydroxy-1,1-dimethyl-ethyl)-3-[3-(p-tolyl)-1-adamantyl]urea Formula: C22H32N2O2 MolecularWeight: 356.50168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)NC(=O)NC(C)(C)CO

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)NC(=O)NC(C)(C)CO

InChI

InChI=1S/C22H32N2O2/c1-15-4-6-18(7-5-15)21-9-16-8-17(10-21)12-22(11-16,13-21)24-19(26)23-20(2,3)14-25/h4-7,16-17,25H,8-14H2,1-3H3,(H2,23,24,26)