O3-ethyl O4-methyl 1-(aminocarbonylamino)-5-methyl-2-oxidanyl-2-(trifluoromethyl)-3H-pyrrole-3,4-dicarboxylate

Systemtic Name: O3-ethyl O4-methyl 1-(aminocarbonylamino)-5-methyl-2-oxidanyl-2-(trifluoromethyl)-3H-pyrrole-3,4-dicarboxylate Openeye Name: O3-ethyl O4-methyl 2-hydroxy-5-methyl-2-(trifluoromethyl)-1-ureido-3H-pyrrole-3,4-dicarboxylate CAS Name: 1-(carbamoylamino)-2-hydroxy-5-methyl-2-(trifluoromethyl)-3H-pyrrole-3,4-dicarboxylic acid O3-ethyl ester O4-methyl ester IUPAC Name: 3-O-ethyl 4-O-methyl 1-(carbamoylamino)-2-hydroxy-5-methyl-2-(trifluoromethyl)-3H-pyrrole-3,4-dicarboxylate Traditional Name: 2-hydroxy-5-methyl-2-(trifluoromethyl)-1-ureido-2-pyrroline-3,4-dicarboxylic acid O3-ethyl ester O4-methyl ester Formula: C12H16F3N3O6 MolecularWeight: 355.26715

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=C(N(C1(C(F)(F)F)O)NC(=O)N)C)C(=O)OC

Isomeric SMILES

CCOC(=O)C1C(=C(N(C1(C(F)(F)F)O)NC(=O)N)C)C(=O)OC

InChI

InChI=1S/C12H16F3N3O6/c1-4-24-9(20)7-6(8(19)23-3)5(2)18(17-10(16)21)11(7,22)12(13,14)15/h7,22H,4H2,1-3H3,(H3,16,17,21)