(4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3-methylcyclohexyl)azanium hydroiodide

Systemtic Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3-methylcyclohexyl)azanium hydroiodide Openeye Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3-methylcyclohexyl)ammonium hydroiodide CAS Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3-methylcyclohexyl)ammonium hydroiodide IUPAC Name: (4-tert-butylphenyl)methyl-carbamimidoyl-methyl-(3-methylcyclohexyl)azanium hydroiodide Traditional Name: amidino-(4-tert-butylbenzyl)-methyl-(3-methylcyclohexyl)ammonium hydroiodide Formula: C20H35IN3+ MolecularWeight: 444.41647

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[N+](C)(CC2=CC=C(C=C2)C(C)(C)C)C(=N)N.I

Isomeric SMILES

CC1CCCC(C1)[N+](C)(CC2=CC=C(C=C2)C(C)(C)C)C(=N)N.I

InChI

InChI=1S/C20H34N3.HI/c1-15-7-6-8-18(13-15)23(5,19(21)22)14-16-9-11-17(12-10-16)20(2,3)4;/h9-12,15,18H,6-8,13-14H2,1-5H3,(H3,21,22);1H/q+1;