1-[2-(3-bromophenyl)-2-oxidanylidene-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide

Systemtic Name: 1-[2-(3-bromophenyl)-2-oxidanylidene-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide Openeye Name: 1-[2-(3-bromophenyl)-2-oxo-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide CAS Name: 1-[2-(3-bromophenyl)-2-oxoethyl]-N-(2-hydroxyethyl)-4-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(3-bromophenyl)-2-oxoethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide Traditional Name: 1-[2-(3-bromophenyl)-2-keto-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide Formula: C16H16BrN2O3+ MolecularWeight: 364.21384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O3/c17-14-3-1-2-13(10-14)15(21)11-19-7-4-12(5-8-19)16(22)18-6-9-20/h1-5,7-8,10,20H,6,9,11H2/p+1