1-(2-adamantyl)-4-(3-chlorophenyl)piperazin-1-ium

Systemtic Name: 1-(2-adamantyl)-4-(3-chlorophenyl)piperazin-1-ium Openeye Name: 1-(2-adamantyl)-4-(3-chlorophenyl)piperazin-1-ium CAS Name: 1-(2-adamantyl)-4-(3-chlorophenyl)piperazin-1-ium IUPAC Name: 1-(2-adamantyl)-4-(3-chlorophenyl)piperazin-1-ium Traditional Name: 1-(2-adamantyl)-4-(3-chlorophenyl)piperazin-1-ium Formula: C20H28ClN2+ MolecularWeight: 331.90272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3CC4CC(C3)CC2C4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CC[NH+]1C2C3CC4CC(C3)CC2C4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C20H27ClN2/c21-18-2-1-3-19(13-18)22-4-6-23(7-5-22)20-16-9-14-8-15(11-16)12-17(20)10-14/h1-3,13-17,20H,4-12H2/p+1