2,4-bis(chloranyl)-N-(pyridin-1-ium-3-ylmethyl)benzamide chloride

Systemtic Name: 2,4-bis(chloranyl)-N-(pyridin-1-ium-3-ylmethyl)benzamide chloride Openeye Name: 2,4-dichloro-N-(pyridin-1-ium-3-ylmethyl)benzamide chloride CAS Name: 2,4-dichloro-N-(3-pyridin-1-iumylmethyl)benzamide chloride IUPAC Name: 2,4-dichloro-N-(pyridin-1-ium-3-ylmethyl)benzamide chloride Traditional Name: 2,4-dichloro-N-(pyridin-1-ium-3-ylmethyl)benzamide chloride Formula: C13H11Cl3N2O MolecularWeight: 317.59824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)CNC(=O)C2=C(C=C(C=C2)Cl)Cl.[Cl-]

Isomeric SMILES

C1=CC(=C[NH+]=C1)CNC(=O)C2=C(C=C(C=C2)Cl)Cl.[Cl-]

InChI

InChI=1S/C13H10Cl2N2O.ClH/c14-10-3-4-11(12(15)6-10)13(18)17-8-9-2-1-5-16-7-9;/h1-7H,8H2,(H,17,18);1H