N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]adamantane-1-carboxamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]adamantane-1-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]adamantane-1-carboxamide Formula: C24H35N3O MolecularWeight: 381.5542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCNC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CC=C5

InChI

InChI=1S/C24H35N3O/c28-23(24-15-20-12-21(16-24)14-22(13-20)17-24)25-6-7-26-8-10-27(11-9-26)18-19-4-2-1-3-5-19/h1-5,20-22H,6-18H2,(H,25,28)