(E)-1-(6-oxidanyl-5-pyrrolidin-1-yl-2H-pyran-4-yl)octadec-9-en-1-one

Systemtic Name: (E)-1-(6-oxidanyl-5-pyrrolidin-1-yl-2H-pyran-4-yl)octadec-9-en-1-one Openeye Name: (E)-1-(6-hydroxy-5-pyrrolidin-1-yl-2H-pyran-4-yl)octadec-9-en-1-one CAS Name: (E)-1-[6-hydroxy-5-(1-pyrrolidinyl)-2H-pyran-4-yl]-9-octadecen-1-one IUPAC Name: (E)-1-(6-hydroxy-5-pyrrolidin-1-yl-2H-pyran-4-yl)octadec-9-en-1-one Traditional Name: (E)-1-(6-hydroxy-5-pyrrolidino-2H-pyran-4-yl)octadec-9-en-1-one Formula: C27H45NO3 MolecularWeight: 431.6511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C1=CCOC(=C1N2CCCC2)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C1=CCOC(=C1N2CCCC2)O

InChI

InChI=1S/C27H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25(29)24-20-23-31-27(30)26(24)28-21-17-18-22-28/h9-10,20,30H,2-8,11-19,21-23H2,1H3/b10-9+