N-[3-[(S)-azanyl-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]phenyl]ethanamide

Systemtic Name: N-[3-[(S)-azanyl-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]phenyl]ethanamide Openeye Name: N-[3-[(S)-amino-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]phenyl]acetamide CAS Name: N-[3-[(S)-amino-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]phenyl]acetamide IUPAC Name: N-[3-[(S)-amino-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]phenyl]acetamide Traditional Name: N-[3-[(S)-amino-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]phenyl]acetamide Formula: C13H17N4O+ MolecularWeight: 245.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(C2=[N+](C=CN2)C)N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)[C@@H](C2=[N+](C=CN2)C)N

InChI

InChI=1S/C13H16N4O/c1-9(18)16-11-5-3-4-10(8-11)12(14)13-15-6-7-17(13)2/h3-8,12H,14H2,1-2H3,(H,16,18)/p+1/t12-/m0/s1