tert-butyl (2S,5R)-2-[(E)-5-ethoxy-5-oxidanylidene-pent-3-enyl]-5-heptyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,5R)-2-[(E)-5-ethoxy-5-oxidanylidene-pent-3-enyl]-5-heptyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,5R)-2-[(E)-5-ethoxy-5-oxo-pent-3-enyl]-5-heptyl-pyrrolidine-1-carboxylate CAS Name: (2S,5R)-2-[(E)-5-ethoxy-5-oxopent-3-enyl]-5-heptyl-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,5R)-2-[(E)-5-ethoxy-5-oxopent-3-enyl]-5-heptylpyrrolidine-1-carboxylate Traditional Name: (2S,5R)-2-[(E)-5-ethoxy-5-keto-pent-3-enyl]-5-heptyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H41NO4 MolecularWeight: 395.57594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(N1C(=O)OC(C)(C)C)CCC=CC(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C23H41NO4/c1-6-8-9-10-11-14-19-17-18-20(15-12-13-16-21(25)27-7-2)24(19)22(26)28-23(3,4)5/h13,16,19-20H,6-12,14-15,17-18H2,1-5H3/b16-13+/t19-,20+/m1/s1