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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCC1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCC(=O)NCC1=[N+](C2=CC=CC=C2N1)CC3=CC=C(C=C3)C

InChI

InChI=1S/C20H23N3O/c1-3-6-20(24)21-13-19-22-17-7-4-5-8-18(17)23(19)14-16-11-9-15(2)10-12-16/h4-5,7-12H,3,6,13-14H2,1-2H3,(H,21,24)/p+1