(E)-18-[2-[2-[(E)-18-oxidanidyl-18-oxidanylidene-octadec-9-enyl]phenyl]phenyl]octadec-9-enoate

Systemtic Name: (E)-18-[2-[2-[(E)-18-oxidanidyl-18-oxidanylidene-octadec-9-enyl]phenyl]phenyl]octadec-9-enoate Openeye Name: (E)-18-[2-[2-[(E)-18-oxido-18-oxo-octadec-9-enyl]phenyl]phenyl]octadec-9-enoate CAS Name: (E)-18-[2-[2-[(E)-18-oxido-18-oxooctadec-9-enyl]phenyl]phenyl]-9-octadecenoate IUPAC Name: (E)-18-[2-[2-[(E)-18-oxido-18-oxooctadec-9-enyl]phenyl]phenyl]octadec-9-enoate Traditional Name: (E)-18-[2-[2-[(E)-18-keto-18-oxido-octadec-9-enyl]phenyl]phenyl]octadec-9-enoate Formula: C48H72O4-2 MolecularWeight: 713.08288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCCCCCCC=CCCCCCCCC(=O)[O-])C2=CC=CC=C2CCCCCCCCC=CCCCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CCCCCCCC/C=C/CCCCCCCC(=O)[O-])C2=CC=CC=C2CCCCCCCC/C=C/CCCCCCCC(=O)[O-]

InChI

InChI=1S/C48H74O4/c49-47(50)41-29-25-21-17-13-9-5-1-3-7-11-15-19-23-27-35-43-37-31-33-39-45(43)46-40-34-32-38-44(46)36-28-24-20-16-12-8-4-2-6-10-14-18-22-26-30-42-48(51)52/h1-2,5-6,31-34,37-40H,3-4,7-30,35-36,41-42H2,(H,49,50)(H,51,52)/p-2/b5-1+,6-2+