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

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C14H12BrN3O3 MolecularWeight: 350.16738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrN3O3/c15-11-5-1-2-6-12(11)17-13(19)8-16-14(20)10-4-3-7-18(21)9-10/h1-7,9H,8H2,(H,16,20)(H,17,19)