3-[4-(2,2-dimethylpropyl)piperazin-4-ium-1-yl]aniline

Systemtic Name: 3-[4-(2,2-dimethylpropyl)piperazin-4-ium-1-yl]aniline Openeye Name: 3-[4-(2,2-dimethylpropyl)piperazin-4-ium-1-yl]aniline CAS Name: 3-[4-(2,2-dimethylpropyl)-1-piperazin-4-iumyl]aniline IUPAC Name: 3-[4-(2,2-dimethylpropyl)piperazin-4-ium-1-yl]aniline Traditional Name: [3-(4-neopentylpiperazin-4-ium-1-yl)phenyl]amine Formula: C15H26N3+ MolecularWeight: 248.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCN(CC1)C2=CC(=CC=C2)N

Isomeric SMILES

CC(C)(C)C[NH+]1CCN(CC1)C2=CC(=CC=C2)N

InChI

InChI=1S/C15H25N3/c1-15(2,3)12-17-7-9-18(10-8-17)14-6-4-5-13(16)11-14/h4-6,11H,7-10,12,16H2,1-3H3/p+1