ethyl 6-methyl-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]heptanoate

Systemtic Name: ethyl 6-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]-6-methyl-heptanoate CAS Name: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]-6-methylheptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]-6-methylheptanoate Traditional Name: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidino]-6-methyl-enanthic acid ethyl ester Formula: C22H39NO4 MolecularWeight: 381.54936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)N1CC(C)CCCCC(=O)OCC)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)N1CC(C)CCCCC(=O)OCC)O

InChI

InChI=1S/C22H39NO4/c1-4-6-7-11-20(24)15-13-19-14-16-21(25)23(19)17-18(3)10-8-9-12-22(26)27-5-2/h13,15,18-20,24H,4-12,14,16-17H2,1-3H3/b15-13+