N-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide Openeye Name: N-[4-[4-(1-naphthyl)piperazin-1-yl]butyl]adamantane-1-carboxamide CAS Name: N-[4-[4-(1-naphthalenyl)-1-piperazinyl]butyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide Traditional Name: N-[4-[4-(1-naphthyl)piperazino]butyl]adamantane-1-carboxamide Formula: C29H39N3O MolecularWeight: 445.63946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H39N3O/c33-28(29-19-22-16-23(20-29)18-24(17-22)21-29)30-10-3-4-11-31-12-14-32(15-13-31)27-9-5-7-25-6-1-2-8-26(25)27/h1-2,5-9,22-24H,3-4,10-21H2,(H,30,33)