tert-butyl 1-[(9Z,12Z)-octadeca-9,12-dienoyl]-5-oxidanylidene-pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[(9Z,12Z)-octadeca-9,12-dienoyl]-5-oxidanylidene-pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[(9Z,12Z)-octadeca-9,12-dienoyl]-5-oxo-pyrrolidine-2-carboxylate CAS Name: 5-oxo-1-[(9Z,12Z)-1-oxooctadeca-9,12-dienyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[(9Z,12Z)-octadeca-9,12-dienoyl]-5-oxopyrrolidine-2-carboxylate Traditional Name: 5-keto-1-[(9Z,12Z)-octadeca-9,12-dienoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C27H45NO4 MolecularWeight: 447.6505

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)N1C(CCC1=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)N1C(CCC1=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(29)28-23(21-22-25(28)30)26(31)32-27(2,3)4/h9-10,12-13,23H,5-8,11,14-22H2,1-4H3/b10-9-,13-12-