5-oxidanyl-5-[2-[(1E,3E)-5-oxidanyltrideca-1,3-dienyl]phenyl]-1-pyrrolidin-1-yl-pentan-1-one

Systemtic Name: 5-oxidanyl-5-[2-[(1E,3E)-5-oxidanyltrideca-1,3-dienyl]phenyl]-1-pyrrolidin-1-yl-pentan-1-one Openeye Name: 5-hydroxy-5-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]-1-pyrrolidin-1-yl-pentan-1-one CAS Name: 5-hydroxy-5-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]-1-(1-pyrrolidinyl)-1-pentanone IUPAC Name: 5-hydroxy-5-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]-1-pyrrolidin-1-ylpentan-1-one Traditional Name: 5-hydroxy-5-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]-1-pyrrolidino-pentan-1-one Formula: C28H43NO3 MolecularWeight: 441.64592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC1=CC=CC=C1C(CCCC(=O)N2CCCC2)O)O

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/C1=CC=CC=C1C(CCCC(=O)N2CCCC2)O)O

InChI

InChI=1S/C28H43NO3/c1-2-3-4-5-6-7-17-25(30)18-10-8-15-24-16-9-11-19-26(24)27(31)20-14-21-28(32)29-22-12-13-23-29/h8-11,15-16,18-19,25,27,30-31H,2-7,12-14,17,20-23H2,1H3/b15-8+,18-10+