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

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide dichloride Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]adamantane-1-carboxamide dichloride CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1-adamantanecarboxamide dichloride IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]adamantane-1-carboxamide dichloride Traditional Name: N-[2-(4-benzylpiperazino)ethyl]adamantane-1-carboxamide dichloride Formula: C24H35Cl2N3O-2 MolecularWeight: 452.4602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CC=C5.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CCN1CCNC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC=CC=C5.[Cl-].[Cl-]

InChI

InChI=1S/C24H35N3O.2ClH/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);2*1H/p-2