bis[4-(benzotriazol-2-yl)phenyl] benzene-1,3-dicarboxylate

Systemtic Name: bis[4-(benzotriazol-2-yl)phenyl] benzene-1,3-dicarboxylate Openeye Name: bis[4-(benzotriazol-2-yl)phenyl] benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis[4-(2-benzotriazolyl)phenyl] ester IUPAC Name: bis[4-(benzotriazol-2-yl)phenyl] benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis[4-(benzotriazol-2-yl)phenyl] ester Formula: C32H20N6O4 MolecularWeight: 552.539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)C(=O)OC5=CC=C(C=C5)N6N=C7C=CC=CC7=N6

Isomeric SMILES

C1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)C(=O)OC5=CC=C(C=C5)N6N=C7C=CC=CC7=N6

InChI

InChI=1S/C32H20N6O4/c39-31(41-25-16-12-23(13-17-25)37-33-27-8-1-2-9-28(27)34-37)21-6-5-7-22(20-21)32(40)42-26-18-14-24(15-19-26)38-35-29-10-3-4-11-30(29)36-38/h1-20H