(4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3,5,5-trimethylhexyl)azanium

Systemtic Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3,5,5-trimethylhexyl)azanium Openeye Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3,5,5-trimethylhexyl)ammonium CAS Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3,5,5-trimethylhexyl)ammonium IUPAC Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3,5,5-trimethylhexyl)azanium Traditional Name: amidino-(4-tert-butylbenzyl)-methyl-(3,5,5-trimethylhexyl)ammonium Formula: C22H40N3+ MolecularWeight: 346.5731

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[N+](C)(CC1=CC=C(C=C1)C(C)(C)C)C(=N)N)CC(C)(C)C

Isomeric SMILES

CC(CC[N+](C)(CC1=CC=C(C=C1)C(C)(C)C)C(=N)N)CC(C)(C)C

InChI

InChI=1S/C22H40N3/c1-17(15-21(2,3)4)13-14-25(8,20(23)24)16-18-9-11-19(12-10-18)22(5,6)7/h9-12,17H,13-16H2,1-8H3,(H3,23,24)/q+1