5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-dicarboxylate

Systemtic Name: 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-dicarboxylate Openeye Name: 5-[(E)-2-(4-bromophenyl)vinyl]benzene-1,3-dicarboxylate CAS Name: 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-dicarboxylate Traditional Name: 5-[(E)-2-(4-bromophenyl)vinyl]isophthalate Formula: C16H9BrO4-2 MolecularWeight: 345.14426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])Br

Isomeric SMILES

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

InChI

InChI=1S/C16H11BrO4/c17-14-5-3-10(4-6-14)1-2-11-7-12(15(18)19)9-13(8-11)16(20)21/h1-9H,(H,18,19)(H,20,21)/p-2/b2-1+