5-bromanyl-6-oxidanylidene-N-(2-piperidin-1-ium-1-ylethyl)pyran-3-carboxamide

Systemtic Name: 5-bromanyl-6-oxidanylidene-N-(2-piperidin-1-ium-1-ylethyl)pyran-3-carboxamide Openeye Name: 5-bromo-6-oxo-N-(2-piperidin-1-ium-1-ylethyl)pyran-3-carboxamide CAS Name: 5-bromo-6-oxo-N-[2-(1-piperidin-1-iumyl)ethyl]-3-pyrancarboxamide IUPAC Name: 5-bromo-6-oxo-N-(2-piperidin-1-ium-1-ylethyl)pyran-3-carboxamide Traditional Name: 5-bromo-6-keto-N-(2-piperidin-1-ium-1-ylethyl)pyran-3-carboxamide Formula: C13H18BrN2O3+ MolecularWeight: 330.19762

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2=COC(=O)C(=C2)Br

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)C2=COC(=O)C(=C2)Br

InChI

InChI=1S/C13H17BrN2O3/c14-11-8-10(9-19-13(11)18)12(17)15-4-7-16-5-2-1-3-6-16/h8-9H,1-7H2,(H,15,17)/p+1