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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C(C)[N+]2=C(NC=C2)C(C)C)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)[C@@H](C)[N+]2=C(NC=C2)C(C)C)N

InChI

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