ethyl 2-[[2-oxidanylidene-2-(prop-2-ynylamino)-1-pyrazol-3-ylidene-ethyl]amino]oxyethanoate

Systemtic Name: ethyl 2-[[2-oxidanylidene-2-(prop-2-ynylamino)-1-pyrazol-3-ylidene-ethyl]amino]oxyethanoate Openeye Name: ethyl 2-[[2-oxo-2-(prop-2-ynylamino)-1-pyrazol-3-ylidene-ethyl]amino]oxyacetate CAS Name: 2-[[2-oxo-2-(prop-2-ynylamino)-1-(3-pyrazolylidene)ethyl]amino]oxyacetic acid ethyl ester IUPAC Name: ethyl 2-[[2-oxo-2-(prop-2-ynylamino)-1-pyrazol-3-ylideneethyl]amino]oxyacetate Traditional Name: 2-[[2-keto-2-(propargylamino)-1-pyrazol-3-ylidene-ethyl]amino]oxyacetic acid ethyl ester Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CONC(=C1C=CN=N1)C(=O)NCC#C

Isomeric SMILES

CCOC(=O)CONC(=C1C=CN=N1)C(=O)NCC#C

InChI

InChI=1S/C12H14N4O4/c1-3-6-13-12(18)11(9-5-7-14-15-9)16-20-8-10(17)19-4-2/h1,5,7,16H,4,6,8H2,2H3,(H,13,18)