1-[2-(4-tert-butylphenoxy)ethyl]-3-(phenylmethyl)benzimidazol-3-ium-2-amine

Systemtic Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3-(phenylmethyl)benzimidazol-3-ium-2-amine Openeye Name: 1-benzyl-3-[2-(4-tert-butylphenoxy)ethyl]benzimidazol-1-ium-2-amine CAS Name: 1-[2-(4-tert-butylphenoxy)ethyl]-3-(phenylmethyl)-2-benzimidazol-3-iumamine IUPAC Name: 1-benzyl-3-[2-(4-tert-butylphenoxy)ethyl]benzimidazol-1-ium-2-amine Traditional Name: [1-benzyl-3-[2-(4-tert-butylphenoxy)ethyl]benzimidazol-1-ium-2-yl]amine Formula: C26H30N3O+ MolecularWeight: 400.5359

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCN2C3=CC=CC=C3[N+](=C2N)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCN2C3=CC=CC=C3[N+](=C2N)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O/c1-26(2,3)21-13-15-22(16-14-21)30-18-17-28-23-11-7-8-12-24(23)29(25(28)27)19-20-9-5-4-6-10-20/h4-16,27H,17-19H2,1-3H3/p+1