[azanyl(pyridin-2-yl)methylidene]-[(2S)-2-(4-bromanylphenoxy)propanoyl]oxy-azanium

Systemtic Name: [azanyl(pyridin-2-yl)methylidene]-[(2S)-2-(4-bromanylphenoxy)propanoyl]oxy-azanium Openeye Name: [amino(2-pyridyl)methylene]-[(2S)-2-(4-bromophenoxy)propanoyl]oxy-ammonium CAS Name: [amino(2-pyridinyl)methylidene]-[(2S)-2-(4-bromophenoxy)-1-oxopropoxy]ammonium IUPAC Name: [amino(pyridin-2-yl)methylidene]-[(2S)-2-(4-bromophenoxy)propanoyl]oxyazanium Traditional Name: [amino(2-pyridyl)methylene]-[(2S)-2-(4-bromophenoxy)propanoyl]oxy-ammonium Formula: C15H15BrN3O3+ MolecularWeight: 365.2019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O[NH+]=C(C1=CC=CC=N1)N)OC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@@H](C(=O)O[NH+]=C(C1=CC=CC=N1)N)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H14BrN3O3/c1-10(21-12-7-5-11(16)6-8-12)15(20)22-19-14(17)13-4-2-3-9-18-13/h2-10H,1H3,(H2,17,19)/p+1/t10-/m0/s1