N-[3-(1H-imidazol-1-ium-1-yl)propyl]-2-methyl-benzamide

Systemtic Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-2-methyl-benzamide Openeye Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-2-methyl-benzamide CAS Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-2-methylbenzamide IUPAC Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-2-methylbenzamide Traditional Name: N-[3-(1H-imidazol-1-ium-1-yl)propyl]-2-methyl-benzamide Formula: C14H18N3O+ MolecularWeight: 244.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC[NH+]2C=CN=C2

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC[NH+]2C=CN=C2

InChI

InChI=1S/C14H17N3O/c1-12-5-2-3-6-13(12)14(18)16-7-4-9-17-10-8-15-11-17/h2-3,5-6,8,10-11H,4,7,9H2,1H3,(H,16,18)/p+1