1-[(2R)-5-(4-chlorophenyl)-5-methyl-hexan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2R)-5-(4-chlorophenyl)-5-methyl-hexan-2-yl]piperazin-4-ium Openeye Name: 1-[(1R)-4-(4-chlorophenyl)-1,4-dimethyl-pentyl]piperazin-4-ium CAS Name: 1-[(2R)-5-(4-chlorophenyl)-5-methylhexan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2R)-5-(4-chlorophenyl)-5-methylhexan-2-yl]piperazin-4-ium Traditional Name: 1-[(1R)-4-(4-chlorophenyl)-1,4-dimethyl-pentyl]piperazin-4-ium Formula: C17H28ClN2+ MolecularWeight: 295.87062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C)(C)C1=CC=C(C=C1)Cl)N2CC[NH2+]CC2

Isomeric SMILES

C[C@H](CCC(C)(C)C1=CC=C(C=C1)Cl)N2CC[NH2+]CC2

InChI

InChI=1S/C17H27ClN2/c1-14(20-12-10-19-11-13-20)8-9-17(2,3)15-4-6-16(18)7-5-15/h4-7,14,19H,8-13H2,1-3H3/p+1/t14-/m1/s1