2-[(4-tert-butylphenyl)methyl-cycloheptyl-amino]ethylazanium

Systemtic Name: 2-[(4-tert-butylphenyl)methyl-cycloheptyl-amino]ethylazanium Openeye Name: 2-[(4-tert-butylphenyl)methyl-cycloheptyl-amino]ethylammonium CAS Name: 2-[(4-tert-butylphenyl)methyl-cycloheptylamino]ethylammonium IUPAC Name: 2-[(4-tert-butylphenyl)methyl-cycloheptylamino]ethylazanium Traditional Name: 2-[(4-tert-butylbenzyl)-cycloheptyl-amino]ethylammonium Formula: C20H35N2+ MolecularWeight: 303.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC[NH3+])C2CCCCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC[NH3+])C2CCCCCC2

InChI

InChI=1S/C20H34N2/c1-20(2,3)18-12-10-17(11-13-18)16-22(15-14-21)19-8-6-4-5-7-9-19/h10-13,19H,4-9,14-16,21H2,1-3H3/p+1