methyl 1-(aminocarbonylamino)-3-ethanoyl-5-methyl-2-oxidanyl-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate

Systemtic Name: methyl 1-(aminocarbonylamino)-3-ethanoyl-5-methyl-2-oxidanyl-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate Openeye Name: methyl 3-acetyl-2-hydroxy-5-methyl-2-(trifluoromethyl)-1-ureido-3H-pyrrole-4-carboxylate CAS Name: 3-acetyl-1-(carbamoylamino)-2-hydroxy-5-methyl-2-(trifluoromethyl)-3H-pyrrole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-acetyl-1-(carbamoylamino)-2-hydroxy-5-methyl-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate Traditional Name: 4-acetyl-5-hydroxy-2-methyl-5-(trifluoromethyl)-1-ureido-2-pyrroline-3-carboxylic acid methyl ester Formula: C11H14F3N3O5 MolecularWeight: 325.24117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(N1NC(=O)N)(C(F)(F)F)O)C(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(C(C(N1NC(=O)N)(C(F)(F)F)O)C(=O)C)C(=O)OC

InChI

InChI=1S/C11H14F3N3O5/c1-4-6(8(19)22-3)7(5(2)18)10(21,11(12,13)14)17(4)16-9(15)20/h7,21H,1-3H3,(H3,15,16,20)