2-[(4-tert-butylphenyl)methyl-(3,5-dimethylphenyl)amino]ethylazanium

Systemtic Name: 2-[(4-tert-butylphenyl)methyl-(3,5-dimethylphenyl)amino]ethylazanium Openeye Name: 2-[N-[(4-tert-butylphenyl)methyl]-3,5-dimethyl-anilino]ethylammonium CAS Name: 2-[N-[(4-tert-butylphenyl)methyl]-3,5-dimethylanilino]ethylammonium IUPAC Name: 2-[N-[(4-tert-butylphenyl)methyl]-3,5-dimethylanilino]ethylazanium Traditional Name: 2-(N-(4-tert-butylbenzyl)-3,5-dimethyl-anilino)ethylammonium Formula: C21H31N2+ MolecularWeight: 311.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC[NH3+])CC2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC[NH3+])CC2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C21H30N2/c1-16-12-17(2)14-20(13-16)23(11-10-22)15-18-6-8-19(9-7-18)21(3,4)5/h6-9,12-14H,10-11,15,22H2,1-5H3/p+1