1-ethylpyridin-1-ium-2,5-dicarboxamide bromide

Systemtic Name: 1-ethylpyridin-1-ium-2,5-dicarboxamide bromide Openeye Name: 1-ethylpyridin-1-ium-2,5-dicarboxamide bromide CAS Name: 1-ethylpyridin-1-ium-2,5-dicarboxamide bromide IUPAC Name: 1-ethylpyridin-1-ium-2,5-dicarboxamide bromide Traditional Name: 1-ethylpyridin-1-ium-2,5-dicarboxamide bromide Formula: C9H12BrN3O2 MolecularWeight: 274.11448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC(=C1)C(=O)N)C(=O)N.[Br-]

Isomeric SMILES

CC[N+]1=C(C=CC(=C1)C(=O)N)C(=O)N.[Br-]

InChI

InChI=1S/C9H11N3O2.BrH/c1-2-12-5-6(8(10)13)3-4-7(12)9(11)14;/h3-5H,2H2,1H3,(H3-,10,11,13,14);1H