(4-tert-butylphenyl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium

Systemtic Name: (4-tert-butylphenyl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium Openeye Name: (4-tert-butylphenyl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: (4-tert-butylphenyl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium Traditional Name: (4-tert-butylbenzyl)-(2-pyrrolidin-1-ium-1-ylethyl)ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CC[NH+]2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CC[NH+]2CCCC2

InChI

InChI=1S/C17H28N2/c1-17(2,3)16-8-6-15(7-9-16)14-18-10-13-19-11-4-5-12-19/h6-9,18H,4-5,10-14H2,1-3H3/p+2