bis(1,2-benzoxazol-3-yl) benzene-1,4-dicarboxylate

Systemtic Name: bis(1,2-benzoxazol-3-yl) benzene-1,4-dicarboxylate Openeye Name: bis(1,2-benzoxazol-3-yl) benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis(1,2-benzoxazol-3-yl) ester IUPAC Name: bis(1,2-benzoxazol-3-yl) benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid diindoxazen-3-yl ester Formula: C22H12N2O6 MolecularWeight: 400.34048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)OC(=O)C3=CC=C(C=C3)C(=O)OC4=NOC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C(=NO2)OC(=O)C3=CC=C(C=C3)C(=O)OC4=NOC5=CC=CC=C54

InChI

InChI=1S/C22H12N2O6/c25-21(27-19-15-5-1-3-7-17(15)29-23-19)13-9-11-14(12-10-13)22(26)28-20-16-6-2-4-8-18(16)30-24-20/h1-12H