tert-butyl (2S,3R)-3-[(2E)-2-(2-ethoxy-2-oxidanylidene-ethylidene)pyrrolidin-1-yl]-2-ethyl-hexanoate

Systemtic Name: tert-butyl (2S,3R)-3-[(2E)-2-(2-ethoxy-2-oxidanylidene-ethylidene)pyrrolidin-1-yl]-2-ethyl-hexanoate Openeye Name: tert-butyl (2S,3R)-3-[(2E)-2-(2-ethoxy-2-oxo-ethylidene)pyrrolidin-1-yl]-2-ethyl-hexanoate CAS Name: (2S,3R)-3-[(2E)-2-(2-ethoxy-2-oxoethylidene)-1-pyrrolidinyl]-2-ethylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-3-[(2E)-2-(2-ethoxy-2-oxoethylidene)pyrrolidin-1-yl]-2-ethylhexanoate Traditional Name: (2S,3R)-3-[(2E)-2-(2-ethoxy-2-keto-ethylidene)pyrrolidino]-2-ethyl-hexanoic acid tert-butyl ester Formula: C20H35NO4 MolecularWeight: 353.4962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)C(=O)OC(C)(C)C)N1CCCC1=CC(=O)OCC

Isomeric SMILES

CCC[C@H]([C@H](CC)C(=O)OC(C)(C)C)N\1CCC/C1=C\C(=O)OCC

InChI

InChI=1S/C20H35NO4/c1-7-11-17(16(8-2)19(23)25-20(4,5)6)21-13-10-12-15(21)14-18(22)24-9-3/h14,16-17H,7-13H2,1-6H3/b15-14+/t16-,17+/m0/s1