methyl (E)-5-oxidanyl-7-[4-(1-oxidanylnonyl)phenyl]hept-2-enoate

Systemtic Name: methyl (E)-5-oxidanyl-7-[4-(1-oxidanylnonyl)phenyl]hept-2-enoate Openeye Name: methyl (E)-5-hydroxy-7-[4-(1-hydroxynonyl)phenyl]hept-2-enoate CAS Name: (E)-5-hydroxy-7-[4-(1-hydroxynonyl)phenyl]-2-heptenoic acid methyl ester IUPAC Name: methyl (E)-5-hydroxy-7-[4-(1-hydroxynonyl)phenyl]hept-2-enoate Traditional Name: (E)-5-hydroxy-7-[4-(1-hydroxynonyl)phenyl]hept-2-enoic acid methyl ester Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C1=CC=C(C=C1)CCC(CC=CC(=O)OC)O)O

Isomeric SMILES

CCCCCCCCC(C1=CC=C(C=C1)CCC(C/C=C/C(=O)OC)O)O

InChI

InChI=1S/C23H36O4/c1-3-4-5-6-7-8-11-22(25)20-16-13-19(14-17-20)15-18-21(24)10-9-12-23(26)27-2/h9,12-14,16-17,21-22,24-25H,3-8,10-11,15,18H2,1-2H3/b12-9+