N-[1-[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethyl]propanamide

Systemtic Name: N-[1-[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethyl]propanamide Openeye Name: N-[1-[3-(p-tolylmethyl)-1H-benzimidazol-3-ium-2-yl]ethyl]propanamide CAS Name: N-[1-[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethyl]propanamide IUPAC Name: N-[1-[3-[(4-methylphenyl)methyl]-1H-benzimidazol-3-ium-2-yl]ethyl]propanamide Traditional Name: N-[1-[3-(4-methylbenzyl)-1H-benzimidazol-3-ium-2-yl]ethyl]propionamide Formula: C20H24N3O+ MolecularWeight: 322.42406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C)C1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)NC(C)C1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)C

InChI

InChI=1S/C20H23N3O/c1-4-19(24)21-15(3)20-22-17-7-5-6-8-18(17)23(20)13-16-11-9-14(2)10-12-16/h5-12,15H,4,13H2,1-3H3,(H,21,24)/p+1