(3E)-2-(3-bromanylthiophen-2-yl)-2-methyl-3-(methylhydrazinylidene)piperidine-1-carboxylic acid

Systemtic Name: (3E)-2-(3-bromanylthiophen-2-yl)-2-methyl-3-(methylhydrazinylidene)piperidine-1-carboxylic acid Openeye Name: (3E)-2-(3-bromo-2-thienyl)-2-methyl-3-(methylhydrazono)piperidine-1-carboxylic acid CAS Name: (3E)-2-(3-bromo-2-thiophenyl)-2-methyl-3-(methylhydrazinylidene)-1-piperidinecarboxylic acid IUPAC Name: (3E)-2-(3-bromothiophen-2-yl)-2-methyl-3-(methylhydrazinylidene)piperidine-1-carboxylic acid Traditional Name: (3E)-2-(3-bromo-2-thienyl)-2-methyl-3-(methylhydrazono)piperidine-1-carboxylic acid Formula: C12H16BrN3O2S MolecularWeight: 346.24334

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NNC)CCCN1C(=O)O)C2=C(C=CS2)Br

Isomeric SMILES

CC1(/C(=N/NC)/CCCN1C(=O)O)C2=C(C=CS2)Br

InChI

InChI=1S/C12H16BrN3O2S/c1-12(10-8(13)5-7-19-10)9(15-14-2)4-3-6-16(12)11(17)18/h5,7,14H,3-4,6H2,1-2H3,(H,17,18)/b15-9+