1-(2-dimethylaminoethyl)-3-[(3-phenyl-1-adamantyl)methyl]urea hydrochloride

Systemtic Name: 1-(2-dimethylaminoethyl)-3-[(3-phenyl-1-adamantyl)methyl]urea hydrochloride Openeye Name: 1-(2-dimethylaminoethyl)-3-[(3-phenyl-1-adamantyl)methyl]urea hydrochloride CAS Name: 1-(2-dimethylaminoethyl)-3-[(3-phenyl-1-adamantyl)methyl]urea hydrochloride IUPAC Name: 1-(2-dimethylaminoethyl)-3-[(3-phenyl-1-adamantyl)methyl]urea hydrochloride Traditional Name: 1-(2-dimethylaminoethyl)-3-[(3-phenyl-1-adamantyl)methyl]urea hydrochloride Formula: C22H34ClN3O MolecularWeight: 391.97786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)NCC12CC3CC(C1)CC(C3)(C2)C4=CC=CC=C4.Cl

Isomeric SMILES

CN(C)CCNC(=O)NCC12CC3CC(C1)CC(C3)(C2)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H33N3O.ClH/c1-25(2)9-8-23-20(26)24-16-21-11-17-10-18(12-21)14-22(13-17,15-21)19-6-4-3-5-7-19;/h3-7,17-18H,8-16H2,1-2H3,(H2,23,24,26);1H