(2R)-N-(4-azanyl-2-methyl-phenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide

Systemtic Name: (2R)-N-(4-azanyl-2-methyl-phenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide Openeye Name: (2R)-N-(4-amino-2-methyl-phenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide CAS Name: (2R)-N-(4-amino-2-methylphenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide IUPAC Name: (2R)-N-(4-amino-2-methylphenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide Traditional Name: (2R)-N-(4-amino-2-methyl-phenyl)-2-(1H-imidazol-3-ium-3-yl)propionamide Formula: C13H17N4O+ MolecularWeight: 245.30028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)NC(=O)C(C)[N+]2=CNC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)N)NC(=O)[C@@H](C)[N+]2=CNC=C2

InChI

InChI=1S/C13H16N4O/c1-9-7-11(14)3-4-12(9)16-13(18)10(2)17-6-5-15-8-17/h3-8,10H,14H2,1-2H3,(H,16,18)/p+1/t10-/m1/s1