2,2-bis[2-[2-[(E)-octadec-9-enyl]phenyl]propan-2-yl]butanedioate

Systemtic Name: 2,2-bis[2-[2-[(E)-octadec-9-enyl]phenyl]propan-2-yl]butanedioate Openeye Name: 2,2-bis[1-methyl-1-[2-[(E)-octadec-9-enyl]phenyl]ethyl]butanedioate CAS Name: 2,2-bis[2-[2-[(E)-octadec-9-enyl]phenyl]propan-2-yl]butanedioate IUPAC Name: 2,2-bis[2-[2-[(E)-octadec-9-enyl]phenyl]propan-2-yl]butanedioate Traditional Name: 2,2-bis[1-methyl-1-[2-[(E)-octadec-9-enyl]phenyl]ethyl]succinate Formula: C58H92O4-2 MolecularWeight: 853.34868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC1=CC=CC=C1C(C)(C)C(CC(=O)[O-])(C(=O)[O-])C(C)(C)C2=CC=CC=C2CCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC1=CC=CC=C1C(C(C(C2=CC=CC=C2CCCCCCCC/C=C/CCCCCCCC)(C)C)(C(=O)[O-])CC(=O)[O-])(C)C

InChI

InChI=1S/C58H94O4/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-43-50-45-39-41-47-52(50)56(3,4)58(55(61)62,49-54(59)60)57(5,6)53-48-42-40-46-51(53)44-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h21-24,39-42,45-48H,7-20,25-38,43-44,49H2,1-6H3,(H,59,60)(H,61,62)/p-2/b23-21+,24-22+