tert-butyl 2-[[4-cyano-2-(2-phenoxyethanoylamino)phenyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[[4-cyano-2-(2-phenoxyethanoylamino)phenyl]amino]ethanoate Openeye Name: tert-butyl 2-[4-cyano-2-[(2-phenoxyacetyl)amino]anilino]acetate CAS Name: 2-[4-cyano-2-[(1-oxo-2-phenoxyethyl)amino]anilino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-cyano-2-[(2-phenoxyacetyl)amino]anilino]acetate Traditional Name: 2-[4-cyano-2-[(2-phenoxyacetyl)amino]anilino]acetic acid tert-butyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC1=C(C=C(C=C1)C#N)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CNC1=C(C=C(C=C1)C#N)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H23N3O4/c1-21(2,3)28-20(26)13-23-17-10-9-15(12-22)11-18(17)24-19(25)14-27-16-7-5-4-6-8-16/h4-11,23H,13-14H2,1-3H3,(H,24,25)