tert-butyl 4-[[(E)-(1-methyl-5-phenoxy-pyrazol-4-yl)methylideneamino]oxymethyl]benzoate

Systemtic Name: tert-butyl 4-[[(E)-(1-methyl-5-phenoxy-pyrazol-4-yl)methylideneamino]oxymethyl]benzoate Openeye Name: tert-butyl 4-[[(E)-(1-methyl-5-phenoxy-pyrazol-4-yl)methyleneamino]oxymethyl]benzoate CAS Name: 4-[[(E)-(1-methyl-5-phenoxy-4-pyrazolyl)methylideneamino]oxymethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(E)-(1-methyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate Traditional Name: 4-[[(E)-(1-methyl-5-phenoxy-pyrazol-4-yl)methyleneamino]oxymethyl]benzoic acid tert-butyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)CON=CC2=C(N(N=C2)C)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)CO/N=C/C2=C(N(N=C2)C)OC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4/c1-23(2,3)30-22(27)18-12-10-17(11-13-18)16-28-25-15-19-14-24-26(4)21(19)29-20-8-6-5-7-9-20/h5-15H,16H2,1-4H3/b25-15+