2,2-bis[[4-(bromomethyl)phenyl]methyl]decanedioate

Systemtic Name: 2,2-bis[[4-(bromomethyl)phenyl]methyl]decanedioate Openeye Name: 2,2-bis[[4-(bromomethyl)phenyl]methyl]decanedioate CAS Name: 2,2-bis[[4-(bromomethyl)phenyl]methyl]decanedioate IUPAC Name: 2,2-bis[[4-(bromomethyl)phenyl]methyl]decanedioate Traditional Name: 2,2-bis[4-(bromomethyl)benzyl]sebacate Formula: C26H30Br2O4-2 MolecularWeight: 566.322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CCCCCCCC(=O)[O-])(CC2=CC=C(C=C2)CBr)C(=O)[O-])CBr

Isomeric SMILES

C1=CC(=CC=C1CC(CCCCCCCC(=O)[O-])(CC2=CC=C(C=C2)CBr)C(=O)[O-])CBr

InChI

InChI=1S/C26H32Br2O4/c27-18-22-11-7-20(8-12-22)16-26(25(31)32,15-5-3-1-2-4-6-24(29)30)17-21-9-13-23(19-28)14-10-21/h7-14H,1-6,15-19H2,(H,29,30)(H,31,32)/p-2