5-bromanyl-N-(2-morpholin-4-ium-4-ylethyl)pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-(2-morpholin-4-ium-4-ylethyl)pyridine-3-carboxamide Openeye Name: 5-bromo-N-(2-morpholin-4-ium-4-ylethyl)pyridine-3-carboxamide CAS Name: 5-bromo-N-[2-(4-morpholin-4-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(2-morpholin-4-ium-4-ylethyl)pyridine-3-carboxamide Traditional Name: 5-bromo-N-(2-morpholin-4-ium-4-ylethyl)nicotinamide Formula: C12H17BrN3O2+ MolecularWeight: 315.18628

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H16BrN3O2/c13-11-7-10(8-14-9-11)12(17)15-1-2-16-3-5-18-6-4-16/h7-9H,1-6H2,(H,15,17)/p+1