ethyl 5-methyl-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]heptanoate

Systemtic Name: ethyl 5-methyl-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]heptanoate Openeye Name: ethyl 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]-5-methyl-heptanoate CAS Name: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]-5-methylheptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]-5-methylheptanoate Traditional Name: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidino]-5-methyl-enanthic acid ethyl ester Formula: C22H39NO4 MolecularWeight: 381.54936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)N1CCC(C)CCCC(=O)OCC)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)N1CCC(C)CCCC(=O)OCC)O

InChI

InChI=1S/C22H39NO4/c1-4-6-7-10-20(24)14-12-19-13-15-21(25)23(19)17-16-18(3)9-8-11-22(26)27-5-2/h12,14,18-20,24H,4-11,13,15-17H2,1-3H3/b14-12+