tert-butyl (2S)-2-[(2R)-4-ethoxy-1-nitro-4-oxidanylidene-butan-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(2R)-4-ethoxy-1-nitro-4-oxidanylidene-butan-2-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(1R)-3-ethoxy-1-(nitromethyl)-3-oxo-propyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(2R)-4-ethoxy-1-nitro-4-oxobutan-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(2R)-4-ethoxy-1-nitro-4-oxobutan-2-yl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(1R)-3-ethoxy-3-keto-1-(nitromethyl)propyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C15H26N2O6 MolecularWeight: 330.37674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C[N+](=O)[O-])C1CCCN1C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C[C@H](C[N+](=O)[O-])[C@@H]1CCCN1C(=O)OC(C)(C)C

InChI

InChI=1S/C15H26N2O6/c1-5-22-13(18)9-11(10-17(20)21)12-7-6-8-16(12)14(19)23-15(2,3)4/h11-12H,5-10H2,1-4H3/t11-,12+/m1/s1