N,N-dimethylcarbamate; (6E)-1-methyl-6-(phenylhydrazinylidene)pyridin-1-ium-3-one; bromide

Systemtic Name: N,N-dimethylcarbamate; (6E)-1-methyl-6-(phenylhydrazinylidene)pyridin-1-ium-3-one; bromide Openeye Name: N,N-dimethylcarbamate; (6E)-1-methyl-6-(phenylhydrazono)pyridin-1-ium-3-one; bromide CAS Name: N,N-dimethylcarbamate; (6E)-1-methyl-6-(phenylhydrazinylidene)-3-pyridin-1-iumone; bromide IUPAC Name: N,N-dimethylcarbamate; (6E)-1-methyl-6-(phenylhydrazinylidene)pyridin-1-ium-3-one; bromide Traditional Name: N,N-dimethylcarbamate; (6E)-1-methyl-6-(phenylhydrazono)pyridin-1-ium-3-one; bromide Formula: C15H18BrN4O3- MolecularWeight: 382.23242

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=O)C=CC1=NNC2=CC=CC=C2.CN(C)C(=O)[O-].[Br-]

Isomeric SMILES

C[N+]\1=CC(=O)C=C/C1=N\NC2=CC=CC=C2.CN(C)C(=O)[O-].[Br-]

InChI

InChI=1S/C12H11N3O.C3H7NO2.BrH/c1-15-9-11(16)7-8-12(15)14-13-10-5-3-2-4-6-10;1-4(2)3(5)6;/h2-9H,1H3;1-2H3,(H,5,6);1H/p-1