1-[(2S)-1-(4-ethylphenyl)propan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2S)-1-(4-ethylphenyl)propan-2-yl]piperazin-4-ium Openeye Name: 1-[(1S)-2-(4-ethylphenyl)-1-methyl-ethyl]piperazin-4-ium CAS Name: 1-[(2S)-1-(4-ethylphenyl)propan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2S)-1-(4-ethylphenyl)propan-2-yl]piperazin-4-ium Traditional Name: 1-[(1S)-2-(4-ethylphenyl)-1-methyl-ethyl]piperazin-4-ium Formula: C15H25N2+ MolecularWeight: 233.3724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(C)N2CC[NH2+]CC2

Isomeric SMILES

CCC1=CC=C(C=C1)C[C@H](C)N2CC[NH2+]CC2

InChI

InChI=1S/C15H24N2/c1-3-14-4-6-15(7-5-14)12-13(2)17-10-8-16-9-11-17/h4-7,13,16H,3,8-12H2,1-2H3/p+1/t13-/m0/s1