N-[1-(3-bromophenyl)ethyl]-1-oxidanidyl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-[1-(3-bromophenyl)ethyl]-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-1-oxido-pyridin-1-ium-2-carboxamide Formula: C14H13BrN2O2 MolecularWeight: 321.16922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC(=O)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC(=O)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C14H13BrN2O2/c1-10(11-5-4-6-12(15)9-11)16-14(18)13-7-2-3-8-17(13)19/h2-10H,1H3,(H,16,18)