dimethyl 5-azanyl-3-[[2-(dimethylamino)-5-nitro-phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[2-(dimethylamino)-5-nitro-phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(dimethylamino)-5-nitro-benzoyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[2-(dimethylamino)-5-nitrophenyl]-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(dimethylamino)-5-nitrobenzoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(dimethylamino)-5-nitro-benzoyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H19N3O8S MolecularWeight: 437.42376

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C18H19N3O8S/c1-20(2)12-6-5-9(21(25)26)7-10(12)16(22)29-8-11-13(17(23)27-3)15(19)30-14(11)18(24)28-4/h5-7H,8,19H2,1-4H3