2-(1-adamantylamino)-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(1-adamantylamino)-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(1-adamantylamino)-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone CAS Name: 2-(1-adamantylamino)-1-[4-(3-chlorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1-adamantylamino)-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(1-adamantylamino)-1-[4-(3-chlorophenyl)piperazino]ethanone Formula: C22H30ClN3O MolecularWeight: 387.9461

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CNC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CNC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30ClN3O/c23-19-2-1-3-20(11-19)25-4-6-26(7-5-25)21(27)15-24-22-12-16-8-17(13-22)10-18(9-16)14-22/h1-3,11,16-18,24H,4-10,12-15H2