ethyl (E)-7-[3-oxidanyl-5-oxidanylidene-1-(3-oxidanylnonyl)pyrrolidin-2-yl]hept-5-enoate

Systemtic Name: ethyl (E)-7-[3-oxidanyl-5-oxidanylidene-1-(3-oxidanylnonyl)pyrrolidin-2-yl]hept-5-enoate Openeye Name: ethyl (E)-7-[3-hydroxy-1-(3-hydroxynonyl)-5-oxo-pyrrolidin-2-yl]hept-5-enoate CAS Name: (E)-7-[3-hydroxy-1-(3-hydroxynonyl)-5-oxo-2-pyrrolidinyl]-5-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[3-hydroxy-1-(3-hydroxynonyl)-5-oxopyrrolidin-2-yl]hept-5-enoate Traditional Name: (E)-7-[3-hydroxy-1-(3-hydroxynonyl)-5-keto-pyrrolidin-2-yl]hept-5-enoic acid ethyl ester Formula: C22H39NO5 MolecularWeight: 397.54876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCN1C(C(CC1=O)O)CC=CCCCC(=O)OCC)O

Isomeric SMILES

CCCCCCC(CCN1C(C(CC1=O)O)C/C=C/CCCC(=O)OCC)O

InChI

InChI=1S/C22H39NO5/c1-3-5-6-9-12-18(24)15-16-23-19(20(25)17-21(23)26)13-10-7-8-11-14-22(27)28-4-2/h7,10,18-20,24-25H,3-6,8-9,11-17H2,1-2H3/b10-7+