(2S)-N-(2-azanyl-4-methoxy-phenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide

Systemtic Name: (2S)-N-(2-azanyl-4-methoxy-phenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide Openeye Name: (2S)-N-(2-amino-4-methoxy-phenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide CAS Name: (2S)-N-(2-amino-4-methoxyphenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide IUPAC Name: (2S)-N-(2-amino-4-methoxyphenyl)-2-(1H-imidazol-3-ium-3-yl)propanamide Traditional Name: (2S)-N-(2-amino-4-methoxy-phenyl)-2-(1H-imidazol-3-ium-3-yl)propionamide Formula: C13H17N4O2+ MolecularWeight: 261.29968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)N)[N+]2=CNC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)OC)N)[N+]2=CNC=C2

InChI

InChI=1S/C13H16N4O2/c1-9(17-6-5-15-8-17)13(18)16-12-4-3-10(19-2)7-11(12)14/h3-9H,14H2,1-2H3,(H,16,18)/p+1/t9-/m0/s1