2,3-bis[4-(benzotriazol-2-yl)phenyl]terephthalate

Systemtic Name: 2,3-bis[4-(benzotriazol-2-yl)phenyl]terephthalate Openeye Name: 2,3-bis[4-(benzotriazol-2-yl)phenyl]terephthalate CAS Name: 2,3-bis[4-(2-benzotriazolyl)phenyl]terephthalate IUPAC Name: 2,3-bis[4-(benzotriazol-2-yl)phenyl]terephthalate Traditional Name: 2,3-bis[4-(benzotriazol-2-yl)phenyl]terephthalate Formula: C32H18N6O4-2 MolecularWeight: 550.52312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)C4=C(C=CC(=C4C5=CC=C(C=C5)N6N=C7C=CC=CC7=N6)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)C4=C(C=CC(=C4C5=CC=C(C=C5)N6N=C7C=CC=CC7=N6)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C32H20N6O4/c39-31(40)23-17-18-24(32(41)42)30(20-11-15-22(16-12-20)38-35-27-7-3-4-8-28(27)36-38)29(23)19-9-13-21(14-10-19)37-33-25-5-1-2-6-26(25)34-37/h1-18H,(H,39,40)(H,41,42)/p-2