diethyl 2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(2-nitrophenyl)methyl]propanedioate

Systemtic Name: diethyl 2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(2-nitrophenyl)methyl]propanedioate Openeye Name: diethyl 2-[(tert-butoxycarbonylamino)-(2-nitrophenyl)methyl]propanedioate CAS Name: 2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-(2-nitrophenyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(2-nitrophenyl)methyl]propanedioate Traditional Name: 2-[(tert-butoxycarbonylamino)-(2-nitrophenyl)methyl]malonic acid diethyl ester Formula: C19H26N2O8 MolecularWeight: 410.41834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1[N+](=O)[O-])NC(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(C1=CC=CC=C1[N+](=O)[O-])NC(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C19H26N2O8/c1-6-27-16(22)14(17(23)28-7-2)15(20-18(24)29-19(3,4)5)12-10-8-9-11-13(12)21(25)26/h8-11,14-15H,6-7H2,1-5H3,(H,20,24)