N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide dichloride

Systemtic Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide dichloride Openeye Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide dichloride CAS Name: N-[2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl]-1-adamantanecarboxamide dichloride IUPAC Name: N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide dichloride Traditional Name: N-[2-[4-(3-chlorophenyl)piperazino]ethyl]adamantane-1-carboxamide dichloride Formula: C23H32Cl3N3O-2 MolecularWeight: 472.87868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC(=CC=C5)Cl.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CCN1CCNC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC(=CC=C5)Cl.[Cl-].[Cl-]

InChI

InChI=1S/C23H32ClN3O.2ClH/c24-20-2-1-3-21(13-20)27-8-6-26(7-9-27)5-4-25-22(28)23-14-17-10-18(15-23)12-19(11-17)16-23;;/h1-3,13,17-19H,4-12,14-16H2,(H,25,28);2*1H/p-2