diethyl 2-[(2-ethoxycarbonyl-3,5-dinitro-phenyl)amino]-2-(ethylamino)propanedioate

Systemtic Name: diethyl 2-[(2-ethoxycarbonyl-3,5-dinitro-phenyl)amino]-2-(ethylamino)propanedioate Openeye Name: diethyl 2-(2-ethoxycarbonyl-3,5-dinitro-anilino)-2-(ethylamino)propanedioate CAS Name: 2-(2-ethoxycarbonyl-3,5-dinitroanilino)-2-(ethylamino)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-ethoxycarbonyl-3,5-dinitroanilino)-2-(ethylamino)propanedioate Traditional Name: 2-(2-carbethoxy-3,5-dinitro-anilino)-2-(ethylamino)malonic acid diethyl ester Formula: C18H24N4O10 MolecularWeight: 456.40396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(C(=O)OCC)(C(=O)OCC)NC1=CC(=CC(=C1C(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCNC(C(=O)OCC)(C(=O)OCC)NC1=CC(=CC(=C1C(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O10/c1-5-19-18(16(24)31-7-3,17(25)32-8-4)20-12-9-11(21(26)27)10-13(22(28)29)14(12)15(23)30-6-2/h9-10,19-20H,5-8H2,1-4H3