tert-butyl 2-[4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]phenoxy]acetate CAS Name: 2-[4-[(E)-[(2-cyano-1-oxoethyl)hydrazinylidene]methyl]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(E)-[(2-cyanoacetyl)hydrazinylidene]methyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]phenoxy]acetic acid tert-butyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=C(C=C1)C=NNC(=O)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=C(C=C1)/C=N/NC(=O)CC#N

InChI

InChI=1S/C16H19N3O4/c1-16(2,3)23-15(21)11-22-13-6-4-12(5-7-13)10-18-19-14(20)8-9-17/h4-7,10H,8,11H2,1-3H3,(H,19,20)/b18-10+