N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-1-oxidanidyl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: 3-bromo-1-oxido-N-piperonyl-pyridin-1-ium-2-carboxamide Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC=[N+]3[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC=[N+]3[O-])Br

InChI

InChI=1S/C14H11BrN2O4/c15-10-2-1-5-17(19)13(10)14(18)16-7-9-3-4-11-12(6-9)21-8-20-11/h1-6H,7-8H2,(H,16,18)