1-[2,7-bis(oxan-2-yl)-7-oxidanyl-heptyl]-5-[(E)-3-oxidanylideneoct-1-enyl]pyrrolidin-2-one

Systemtic Name: 1-[2,7-bis(oxan-2-yl)-7-oxidanyl-heptyl]-5-[(E)-3-oxidanylideneoct-1-enyl]pyrrolidin-2-one Openeye Name: 1-[7-hydroxy-2,7-di(tetrahydropyran-2-yl)heptyl]-5-[(E)-3-oxooct-1-enyl]pyrrolidin-2-one CAS Name: 1-[7-hydroxy-2,7-bis(2-oxanyl)heptyl]-5-[(E)-3-oxooct-1-enyl]-2-pyrrolidinone IUPAC Name: 1-[7-hydroxy-2,7-bis(oxan-2-yl)heptyl]-5-[(E)-3-oxooct-1-enyl]pyrrolidin-2-one Traditional Name: 1-[7-hydroxy-2,7-di(tetrahydropyran-2-yl)heptyl]-5-[(E)-3-ketooct-1-enyl]-2-pyrrolidone Formula: C29H49NO5 MolecularWeight: 491.70306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C=CC1CCC(=O)N1CC(CCCCC(C2CCCCO2)O)C3CCCCO3

Isomeric SMILES

CCCCCC(=O)/C=C/C1CCC(=O)N1CC(CCCCC(C2CCCCO2)O)C3CCCCO3

InChI

InChI=1S/C29H49NO5/c1-2-3-4-12-25(31)18-16-24-17-19-29(33)30(24)22-23(27-14-7-9-20-34-27)11-5-6-13-26(32)28-15-8-10-21-35-28/h16,18,23-24,26-28,32H,2-15,17,19-22H2,1H3/b18-16+