5-[(1R,5R)-5-heptyl-2-oct-1-ynyl-4-oxidanylidene-cyclopent-2-en-1-yl]oxy-N-propyl-pentanamide

Systemtic Name: 5-[(1R,5R)-5-heptyl-2-oct-1-ynyl-4-oxidanylidene-cyclopent-2-en-1-yl]oxy-N-propyl-pentanamide Openeye Name: 5-[(1R,5R)-5-heptyl-2-oct-1-ynyl-4-oxo-cyclopent-2-en-1-yl]oxy-N-propyl-pentanamide CAS Name: 5-[[(1R,5R)-5-heptyl-2-oct-1-ynyl-4-oxo-1-cyclopent-2-enyl]oxy]-N-propylpentanamide IUPAC Name: 5-[(1R,5R)-5-heptyl-2-oct-1-ynyl-4-oxocyclopent-2-en-1-yl]oxy-N-propylpentanamide Traditional Name: 5-[(1R,5R)-5-heptyl-4-keto-2-oct-1-ynyl-cyclopent-2-en-1-yl]oxy-N-propyl-valeramide Formula: C28H47NO3 MolecularWeight: 445.67768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(C(=CC1=O)C#CCCCCCC)OCCCCC(=O)NCCC

Isomeric SMILES

CCCCCCC[C@@H]1[C@H](C(=CC1=O)C#CCCCCCC)OCCCCC(=O)NCCC

InChI

InChI=1S/C28H47NO3/c1-4-7-9-11-13-14-18-24-23-26(30)25(19-15-12-10-8-5-2)28(24)32-22-17-16-20-27(31)29-21-6-3/h23,25,28H,4-13,15-17,19-22H2,1-3H3,(H,29,31)/t25-,28-/m0/s1