(4-tert-butylphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: (4-tert-butylphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: (4-tert-butylphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: (4-tert-butylphenyl)methyl-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: (4-tert-butylphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: (4-tert-butylbenzyl)-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C19H34N2+2 MolecularWeight: 290.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C19H32N2/c1-19(2,3)18-10-8-17(9-11-18)16-20-12-7-15-21-13-5-4-6-14-21/h8-11,20H,4-7,12-16H2,1-3H3/p+2