ethyl 2-[[2-[1-(2,6-dimethylphenoxy)propan-2-ylamino]-2-oxidanylidene-1-pyrazol-3-ylidene-ethyl]amino]oxyethanoate

Systemtic Name: ethyl 2-[[2-[1-(2,6-dimethylphenoxy)propan-2-ylamino]-2-oxidanylidene-1-pyrazol-3-ylidene-ethyl]amino]oxyethanoate Openeye Name: ethyl 2-[[2-[[2-(2,6-dimethylphenoxy)-1-methyl-ethyl]amino]-2-oxo-1-pyrazol-3-ylidene-ethyl]amino]oxyacetate CAS Name: 2-[[2-[1-(2,6-dimethylphenoxy)propan-2-ylamino]-2-oxo-1-(3-pyrazolylidene)ethyl]amino]oxyacetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[1-(2,6-dimethylphenoxy)propan-2-ylamino]-2-oxo-1-pyrazol-3-ylideneethyl]amino]oxyacetate Traditional Name: 2-[[2-[[2-(2,6-dimethylphenoxy)-1-methyl-ethyl]amino]-2-keto-1-pyrazol-3-ylidene-ethyl]amino]oxyacetic acid ethyl ester Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CONC(=C1C=CN=N1)C(=O)NC(C)COC2=C(C=CC=C2C)C

Isomeric SMILES

CCOC(=O)CONC(=C1C=CN=N1)C(=O)NC(C)COC2=C(C=CC=C2C)C

InChI

InChI=1S/C20H26N4O5/c1-5-27-17(25)12-29-24-18(16-9-10-21-23-16)20(26)22-15(4)11-28-19-13(2)7-6-8-14(19)3/h6-10,15,24H,5,11-12H2,1-4H3,(H,22,26)