1,8-bis(benzotriazol-1-yl)octane-2,7-dione

Systemtic Name: 1,8-bis(benzotriazol-1-yl)octane-2,7-dione Openeye Name: 1,8-bis(benzotriazol-1-yl)octane-2,7-dione CAS Name: 1,8-bis(1-benzotriazolyl)octane-2,7-dione IUPAC Name: 1,8-bis(benzotriazol-1-yl)octane-2,7-dione Traditional Name: 1,8-bis(benzotriazol-1-yl)octane-2,7-dione Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC(=O)CCCCC(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC(=O)CCCCC(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H20N6O2/c27-15(13-25-19-11-5-3-9-17(19)21-23-25)7-1-2-8-16(28)14-26-20-12-6-4-10-18(20)22-24-26/h3-6,9-12H,1-2,7-8,13-14H2