2-[2-(hydroxymethyl)-3H-benzimidazol-1-ium-1-yl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-(hydroxymethyl)-3H-benzimidazol-1-ium-1-yl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[2-(hydroxymethyl)-3H-benzimidazol-1-ium-1-yl]-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[2-(hydroxymethyl)-3H-benzimidazol-1-ium-1-yl]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[2-(hydroxymethyl)-3H-benzimidazol-1-ium-1-yl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-(2-methylol-3H-benzimidazol-1-ium-1-yl)-N-phenyl-acetamide Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)C[N+]2=C(NC3=CC=CC=C32)CO

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)C[N+]2=C(NC3=CC=CC=C32)CO

InChI

InChI=1S/C19H21N3O2/c1-14(2)22(15-8-4-3-5-9-15)19(24)12-21-17-11-7-6-10-16(17)20-18(21)13-23/h3-11,14,23H,12-13H2,1-2H3/p+1