2-[1-(3-bromophenyl)-2-piperazin-1-yl-ethyl]adamantan-2-ol

Systemtic Name: 2-[1-(3-bromophenyl)-2-piperazin-1-yl-ethyl]adamantan-2-ol Openeye Name: 2-[1-(3-bromophenyl)-2-piperazin-1-yl-ethyl]adamantan-2-ol CAS Name: 2-[1-(3-bromophenyl)-2-(1-piperazinyl)ethyl]-2-adamantanol IUPAC Name: 2-[1-(3-bromophenyl)-2-piperazin-1-ylethyl]adamantan-2-ol Traditional Name: 2-[1-(3-bromophenyl)-2-piperazino-ethyl]adamantan-2-ol Formula: C22H31BrN2O MolecularWeight: 419.39834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(C2=CC(=CC=C2)Br)C3(C4CC5CC(C4)CC3C5)O

Isomeric SMILES

C1CN(CCN1)CC(C2=CC(=CC=C2)Br)C3(C4CC5CC(C4)CC3C5)O

InChI

InChI=1S/C22H31BrN2O/c23-20-3-1-2-17(13-20)21(14-25-6-4-24-5-7-25)22(26)18-9-15-8-16(11-18)12-19(22)10-15/h1-3,13,15-16,18-19,21,24,26H,4-12,14H2