(Z)-2-diazonio-1-ethoxy-5-phenyl-3-[2,2,2-tris(chloranyl)ethanoylamino]pent-1-en-4-yn-1-olate

Systemtic Name: (Z)-2-diazonio-1-ethoxy-5-phenyl-3-[2,2,2-tris(chloranyl)ethanoylamino]pent-1-en-4-yn-1-olate Openeye Name: (Z)-2-diazonio-1-ethoxy-5-phenyl-3-[(2,2,2-trichloroacetyl)amino]pent-1-en-4-yn-1-olate CAS Name: (Z)-2-diazonio-1-ethoxy-5-phenyl-3-[(2,2,2-trichloro-1-oxoethyl)amino]-1-pent-1-en-4-ynolate IUPAC Name: (Z)-2-diazonio-1-ethoxy-5-phenyl-3-[(2,2,2-trichloroacetyl)amino]pent-1-en-4-yn-1-olate Traditional Name: (Z)-2-diazonio-1-ethoxy-5-phenyl-3-[(2,2,2-trichloroacetyl)amino]pent-1-en-4-yn-1-olate Formula: C15H12Cl3N3O3 MolecularWeight: 388.63308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(C#CC1=CC=CC=C1)NC(=O)C(Cl)(Cl)Cl)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(/C(C#CC1=CC=CC=C1)NC(=O)C(Cl)(Cl)Cl)\[N+]#N)/[O-]

InChI

InChI=1S/C15H12Cl3N3O3/c1-2-24-13(22)12(21-19)11(20-14(23)15(16,17)18)9-8-10-6-4-3-5-7-10/h3-7,11H,2H2,1H3,(H-,20,22,23)/b13-12-