O1-ethyl O2-methyl (1S,2R,3S)-3-tert-butyl-1-cyano-cyclopropane-1,2-dicarboxylate

Systemtic Name: O1-ethyl O2-methyl (1S,2R,3S)-3-tert-butyl-1-cyano-cyclopropane-1,2-dicarboxylate Openeye Name: O1-ethyl O2-methyl (1S,2R,3S)-3-tert-butyl-1-cyano-cyclopropane-1,2-dicarboxylate CAS Name: (1S,2R,3S)-3-tert-butyl-1-cyanocyclopropane-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester IUPAC Name: 1-O-ethyl 2-O-methyl (1S,2R,3S)-3-tert-butyl-1-cyanocyclopropane-1,2-dicarboxylate Traditional Name: (1S,2R,3S)-3-tert-butyl-1-cyano-cyclopropane-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester Formula: C13H19NO4 MolecularWeight: 253.29426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C1C(C)(C)C)C(=O)OC)C#N

Isomeric SMILES

CCOC(=O)[C@@]1([C@@H]([C@H]1C(C)(C)C)C(=O)OC)C#N

InChI

InChI=1S/C13H19NO4/c1-6-18-11(16)13(7-14)8(10(15)17-5)9(13)12(2,3)4/h8-9H,6H2,1-5H3/t8-,9-,13+/m0/s1