tert-butyl 2-[[2-[(4-chlorophenyl)carbonylamino]-2-oxidanylidene-ethanoyl]amino]-2-cyano-3-oxidanylidene-3-phenyl-propanoate

Systemtic Name: tert-butyl 2-[[2-[(4-chlorophenyl)carbonylamino]-2-oxidanylidene-ethanoyl]amino]-2-cyano-3-oxidanylidene-3-phenyl-propanoate Openeye Name: tert-butyl 2-[[2-[(4-chlorobenzoyl)amino]-2-oxo-acetyl]amino]-2-cyano-3-oxo-3-phenyl-propanoate CAS Name: 2-[[2-[[(4-chlorophenyl)-oxomethyl]amino]-1,2-dioxoethyl]amino]-2-cyano-3-oxo-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-[(4-chlorobenzoyl)amino]-2-oxoacetyl]amino]-2-cyano-3-oxo-3-phenylpropanoate Traditional Name: 2-[[2-[(4-chlorobenzoyl)amino]-2-keto-acetyl]amino]-2-cyano-3-keto-3-phenyl-propionic acid tert-butyl ester Formula: C23H20ClN3O6 MolecularWeight: 469.8744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20ClN3O6/c1-22(2,3)33-21(32)23(13-25,17(28)14-7-5-4-6-8-14)27-20(31)19(30)26-18(29)15-9-11-16(24)12-10-15/h4-12H,1-3H3,(H,27,31)(H,26,29,30)