N-(2-hydroxyethyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide

Systemtic Name: N-(2-hydroxyethyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide Openeye Name: N-(2-hydroxyethyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide CAS Name: N-(2-hydroxyethyl)-1-phenacyl-3-pyridin-1-iumcarboxamide bromide IUPAC Name: N-(2-hydroxyethyl)-1-phenacylpyridin-1-ium-3-carboxamide bromide Traditional Name: N-(2-hydroxyethyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide Formula: C16H17BrN2O3 MolecularWeight: 365.22178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)NCCO.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)NCCO.[Br-]

InChI

InChI=1S/C16H16N2O3.BrH/c19-10-8-17-16(21)14-7-4-9-18(11-14)12-15(20)13-5-2-1-3-6-13;/h1-7,9,11,19H,8,10,12H2;1H