1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]piperazin-4-ium

Systemtic Name: 1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]piperazin-4-ium Openeye Name: 1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]piperazin-4-ium CAS Name: 1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-tert-butyl-2,6-dimethyl-benzyl)piperazin-4-ium Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CN2CC[NH2+]CC2)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CN2CC[NH2+]CC2)C)C(C)(C)C

InChI

InChI=1S/C17H28N2/c1-13-10-15(17(3,4)5)11-14(2)16(13)12-19-8-6-18-7-9-19/h10-11,18H,6-9,12H2,1-5H3/p+1