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

Systemtic Name: diethyl 2-(ethylamino)-2-[[2-(ethylcarbamoyl)-3,5-dinitro-phenyl]amino]propanedioate Openeye Name: diethyl 2-(ethylamino)-2-[2-(ethylcarbamoyl)-3,5-dinitro-anilino]propanedioate CAS Name: 2-(ethylamino)-2-[2-(ethylcarbamoyl)-3,5-dinitroanilino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(ethylamino)-2-[2-(ethylcarbamoyl)-3,5-dinitroanilino]propanedioate Traditional Name: 2-(ethylamino)-2-[2-(ethylcarbamoyl)-3,5-dinitro-anilino]malonic acid diethyl ester Formula: C18H25N5O9 MolecularWeight: 455.4192

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(C=C(C=C1NC(C(=O)OCC)(C(=O)OCC)NCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)C1=C(C=C(C=C1NC(C(=O)OCC)(C(=O)OCC)NCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O9/c1-5-19-15(24)14-12(9-11(22(27)28)10-13(14)23(29)30)21-18(20-6-2,16(25)31-7-3)17(26)32-8-4/h9-10,20-21H,5-8H2,1-4H3,(H,19,24)