tert-butyl (2S)-2-(2-methylpropyl)-5-oxidanylidene-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-(2-methylpropyl)-5-oxidanylidene-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl (2S)-2-isobutyl-5-oxo-2H-pyrrole-1-carboxylate CAS Name: (2S)-2-(2-methylpropyl)-5-oxo-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(2-methylpropyl)-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: (2S)-2-isobutyl-5-keto-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C=CC(=O)N1C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@H]1C=CC(=O)N1C(=O)OC(C)(C)C

InChI

InChI=1S/C13H21NO3/c1-9(2)8-10-6-7-11(15)14(10)12(16)17-13(3,4)5/h6-7,9-10H,8H2,1-5H3/t10-/m1/s1