N-[2-[(4-phenoxyphenyl)methyl]-1H-benzimidazol-1-ium-5-yl]ethanamide

Systemtic Name: N-[2-[(4-phenoxyphenyl)methyl]-1H-benzimidazol-1-ium-5-yl]ethanamide Openeye Name: N-[2-[(4-phenoxyphenyl)methyl]-1H-benzimidazol-1-ium-5-yl]acetamide CAS Name: N-[2-[(4-phenoxyphenyl)methyl]-1H-benzimidazol-1-ium-5-yl]acetamide IUPAC Name: N-[2-[(4-phenoxyphenyl)methyl]-1H-benzimidazol-1-ium-5-yl]acetamide Traditional Name: N-[2-(4-phenoxybenzyl)-1H-benzimidazol-1-ium-5-yl]acetamide Formula: C22H20N3O2+ MolecularWeight: 358.4131

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)[NH2+]C(=N2)CC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)[NH2+]C(=N2)CC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H19N3O2/c1-15(26)23-17-9-12-20-21(14-17)25-22(24-20)13-16-7-10-19(11-8-16)27-18-5-3-2-4-6-18/h2-12,14H,13H2,1H3,(H,23,26)(H,24,25)/p+1