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

Systemtic Name: 1-[(1S)-1-(4-chlorophenyl)-2-methyl-propyl]piperazin-4-ium Openeye Name: 1-[(1S)-1-(4-chlorophenyl)-2-methyl-propyl]piperazin-4-ium CAS Name: 1-[(1S)-1-(4-chlorophenyl)-2-methylpropyl]piperazin-4-ium IUPAC Name: 1-[(1S)-1-(4-chlorophenyl)-2-methylpropyl]piperazin-4-ium Traditional Name: 1-[(1S)-1-(4-chlorophenyl)-2-methyl-propyl]piperazin-4-ium Formula: C14H22ClN2+ MolecularWeight: 253.79088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21ClN2/c1-11(2)14(17-9-7-16-8-10-17)12-3-5-13(15)6-4-12/h3-6,11,14,16H,7-10H2,1-2H3/p+1/t14-/m0/s1