3,4-bis(benzotriazol-1-yl)-3,4-diethanoyl-hexane-2,5-dione

Systemtic Name: 3,4-bis(benzotriazol-1-yl)-3,4-diethanoyl-hexane-2,5-dione Openeye Name: 3,4-diacetyl-3,4-bis(benzotriazol-1-yl)hexane-2,5-dione CAS Name: 3,4-diacetyl-3,4-bis(1-benzotriazolyl)hexane-2,5-dione IUPAC Name: 3,4-diacetyl-3,4-bis(benzotriazol-1-yl)hexane-2,5-dione Traditional Name: 3,4-diacetyl-3,4-bis(benzotriazol-1-yl)hexane-2,5-dione Formula: C22H20N6O4 MolecularWeight: 432.432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)(C(C(=O)C)(C(=O)C)N1C2=CC=CC=C2N=N1)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(=O)C(C(=O)C)(C(C(=O)C)(C(=O)C)N1C2=CC=CC=C2N=N1)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H20N6O4/c1-13(29)21(14(2)30,27-19-11-7-5-9-17(19)23-25-27)22(15(3)31,16(4)32)28-20-12-8-6-10-18(20)24-26-28/h5-12H,1-4H3