2-[(2E)-2-[5-oxidanylidene-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]hydrazinyl]benzoate

Systemtic Name: 2-[(2E)-2-[5-oxidanylidene-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]hydrazinyl]benzoate Openeye Name: 2-[(2E)-2-[5-oxo-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]hydrazino]benzoate CAS Name: 2-[(2E)-2-[5-oxo-1-phenyl-3-(trifluoromethyl)-4-pyrazolylidene]hydrazinyl]benzoate IUPAC Name: 2-[(2E)-2-[5-oxo-1-phenyl-3-(trifluoromethyl)pyrazol-4-ylidene]hydrazinyl]benzoate Traditional Name: 2-[(N'E)-N'-[5-keto-1-phenyl-3-(trifluoromethyl)-2-pyrazolin-4-ylidene]hydrazino]benzoate Formula: C17H10F3N4O3- MolecularWeight: 375.28151

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=NNC3=CC=CC=C3C(=O)[O-])C(=N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=N/NC3=CC=CC=C3C(=O)[O-])/C(=N2)C(F)(F)F

InChI

InChI=1S/C17H11F3N4O3/c18-17(19,20)14-13(15(25)24(23-14)10-6-2-1-3-7-10)22-21-12-9-5-4-8-11(12)16(26)27/h1-9,21H,(H,26,27)/p-1/b22-13+