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

Systemtic Name: (2R)-N-(4-azanyl-2-methyl-phenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propanamide Openeye Name: (2R)-N-(4-amino-2-methyl-phenyl)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)propanamide CAS Name: (2R)-N-(4-amino-2-methylphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propanamide IUPAC Name: (2R)-N-(4-amino-2-methylphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propanamide Traditional Name: (2R)-N-(4-amino-2-methyl-phenyl)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)propionamide Formula: C16H23N4O+ MolecularWeight: 287.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O/c1-10(2)15-18-7-8-20(15)12(4)16(21)19-14-6-5-13(17)9-11(14)3/h5-10,12H,17H2,1-4H3,(H,19,21)/p+1/t12-/m1/s1