tert-butyl (2R)-2-(4-chlorophenyl)-2-cyano-2-[methoxycarbonyl-(methoxycarbonylamino)amino]ethanoate

Systemtic Name: tert-butyl (2R)-2-(4-chlorophenyl)-2-cyano-2-[methoxycarbonyl-(methoxycarbonylamino)amino]ethanoate Openeye Name: tert-butyl (2R)-2-(4-chlorophenyl)-2-cyano-2-[methoxycarbonyl-(methoxycarbonylamino)amino]acetate CAS Name: (2R)-2-(4-chlorophenyl)-2-cyano-2-[methoxycarbonyl-(methoxycarbonylamino)amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-(4-chlorophenyl)-2-cyano-2-[methoxycarbonyl-(methoxycarbonylamino)amino]acetate Traditional Name: (2R)-2-[carbomethoxy-(carbomethoxyamino)amino]-2-(4-chlorophenyl)-2-cyano-acetic acid tert-butyl ester Formula: C17H20ClN3O6 MolecularWeight: 397.8102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)[C@](C#N)(C1=CC=C(C=C1)Cl)N(C(=O)OC)NC(=O)OC

InChI

InChI=1S/C17H20ClN3O6/c1-16(2,3)27-13(22)17(10-19,11-6-8-12(18)9-7-11)21(15(24)26-5)20-14(23)25-4/h6-9H,1-5H3,(H,20,23)/t17-/m0/s1