diethyl 2-(3-methyl-4-nitro-phenyl)propanedioate

Systemtic Name: diethyl 2-(3-methyl-4-nitro-phenyl)propanedioate Openeye Name: diethyl 2-(3-methyl-4-nitro-phenyl)propanedioate CAS Name: 2-(3-methyl-4-nitrophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-methyl-4-nitrophenyl)propanedioate Traditional Name: 2-(3-methyl-4-nitro-phenyl)malonic acid diethyl ester Formula: C14H17NO6 MolecularWeight: 295.28788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO6/c1-4-20-13(16)12(14(17)21-5-2)10-6-7-11(15(18)19)9(3)8-10/h6-8,12H,4-5H2,1-3H3