1-(2-adamantyl)-4-[(2-chlorophenyl)methyl]piperazin-1-ium

Systemtic Name: 1-(2-adamantyl)-4-[(2-chlorophenyl)methyl]piperazin-1-ium Openeye Name: 1-(2-adamantyl)-4-[(2-chlorophenyl)methyl]piperazin-1-ium CAS Name: 1-(2-adamantyl)-4-[(2-chlorophenyl)methyl]piperazin-1-ium IUPAC Name: 1-(2-adamantyl)-4-[(2-chlorophenyl)methyl]piperazin-1-ium Traditional Name: 1-(2-adamantyl)-4-(2-chlorobenzyl)piperazin-1-ium Formula: C21H30ClN2+ MolecularWeight: 345.9293

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3CC4CC(C3)CC2C4)CC5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CC[NH+]1C2C3CC4CC(C3)CC2C4)CC5=CC=CC=C5Cl

InChI

InChI=1S/C21H29ClN2/c22-20-4-2-1-3-17(20)14-23-5-7-24(8-6-23)21-18-10-15-9-16(12-18)13-19(21)11-15/h1-4,15-16,18-19,21H,5-14H2/p+1