[2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-methoxyethanoate

Systemtic Name: [2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-methoxyethanoate Openeye Name: [2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [2-[(5-tert-butyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-tert-butyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)COC(=O)COC)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)COC(=O)COC)C2=CC=CC=C2

InChI

InChI=1S/C18H23N3O4/c1-18(2,3)14-10-15(19-16(22)11-25-17(23)12-24-4)21(20-14)13-8-6-5-7-9-13/h5-10H,11-12H2,1-4H3,(H,19,22)