2,5-bis[(4-bromophenyl)methyl]terephthalic acid

Systemtic Name: 2,5-bis[(4-bromophenyl)methyl]terephthalic acid Openeye Name: 2,5-bis[(4-bromophenyl)methyl]terephthalic acid CAS Name: 2,5-bis[(4-bromophenyl)methyl]terephthalic acid IUPAC Name: 2,5-bis[(4-bromophenyl)methyl]terephthalic acid Traditional Name: 2,5-bis(4-bromobenzyl)terephthalic acid Formula: C22H16Br2O4 MolecularWeight: 504.16804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC(=C(C=C2C(=O)O)CC3=CC=C(C=C3)Br)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1CC2=CC(=C(C=C2C(=O)O)CC3=CC=C(C=C3)Br)C(=O)O)Br

InChI

InChI=1S/C22H16Br2O4/c23-17-5-1-13(2-6-17)9-15-11-20(22(27)28)16(12-19(15)21(25)26)10-14-3-7-18(24)8-4-14/h1-8,11-12H,9-10H2,(H,25,26)(H,27,28)