(4E)-4-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]-4-phenyl-butanoate

Systemtic Name: (4E)-4-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]-4-phenyl-butanoate Openeye Name: (4E)-4-[(5-bromopyridine-3-carbonyl)hydrazono]-4-phenyl-butanoate CAS Name: (4E)-4-[[(5-bromo-3-pyridinyl)-oxomethyl]hydrazinylidene]-4-phenylbutanoate IUPAC Name: (4E)-4-[(5-bromopyridine-3-carbonyl)hydrazinylidene]-4-phenylbutanoate Traditional Name: (4E)-4-[(5-bromonicotinoyl)hydrazono]-4-phenyl-butyrate Formula: C16H13BrN3O3- MolecularWeight: 375.19672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NNC(=O)C2=CC(=CN=C2)Br)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C(=N/NC(=O)C2=CC(=CN=C2)Br)/CCC(=O)[O-]

InChI

InChI=1S/C16H14BrN3O3/c17-13-8-12(9-18-10-13)16(23)20-19-14(6-7-15(21)22)11-4-2-1-3-5-11/h1-5,8-10H,6-7H2,(H,20,23)(H,21,22)/p-1/b19-14+