O4-ethyl O2-[(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[(2S)-1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[(1S)-2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(2S)-1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: 4-O-ethyl 2-O-[(2S)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[(1S)-2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H25N3O6 MolecularWeight: 367.3969

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)O[C@@H](C)C(=O)NC(=O)NC(C)C)C

InChI

InChI=1S/C17H25N3O6/c1-7-25-15(22)12-9(4)13(19-10(12)5)16(23)26-11(6)14(21)20-17(24)18-8(2)3/h8,11,19H,7H2,1-6H3,(H2,18,20,21,24)/t11-/m0/s1