2-(3-oxidanyl-1-adamantyl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(3-oxidanyl-1-adamantyl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(3-hydroxy-1-adamantyl)acetamide CAS Name: 2-(3-hydroxy-1-adamantyl)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(3-hydroxy-1-adamantyl)acetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-(3-hydroxy-1-adamantyl)acetamide Formula: C29H37N3O2 MolecularWeight: 459.62298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CC45CC6CC(C4)CC(C6)(C5)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CC45CC6CC(C4)CC(C6)(C5)O

InChI

InChI=1S/C29H37N3O2/c33-27(19-28-15-23-14-24(16-28)18-29(34,17-23)21-28)30-25-6-8-26(9-7-25)32-12-10-31(11-13-32)20-22-4-2-1-3-5-22/h1-9,23-24,34H,10-21H2,(H,30,33)