1,4-bis(benzotriazol-1-yl)butane-1,4-dione

Systemtic Name: 1,4-bis(benzotriazol-1-yl)butane-1,4-dione Openeye Name: 1,4-bis(benzotriazol-1-yl)butane-1,4-dione CAS Name: 1,4-bis(1-benzotriazolyl)butane-1,4-dione IUPAC Name: 1,4-bis(benzotriazol-1-yl)butane-1,4-dione Traditional Name: 1,4-bis(benzotriazol-1-yl)butane-1,4-dione Formula: C16H12N6O2 MolecularWeight: 320.30548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=O)CCC(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(=O)CCC(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H12N6O2/c23-15(21-13-7-3-1-5-11(13)17-19-21)9-10-16(24)22-14-8-4-2-6-12(14)18-20-22/h1-8H,9-10H2