5,5-bis(2H-benzotriazol-5-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5,5-bis(2H-benzotriazol-5-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5,5-bis(2H-benzotriazol-5-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5,5-bis(2H-benzotriazol-5-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5,5-bis(2H-benzotriazol-5-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5,5-bis(2H-benzotriazol-5-ylmethyl)-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C20H18N6O4 MolecularWeight: 406.39472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC2=CC3=NNN=C3C=C2)CC4=CC5=NNN=C5C=C4)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CC2=CC3=NNN=C3C=C2)CC4=CC5=NNN=C5C=C4)C

InChI

InChI=1S/C20H18N6O4/c1-19(2)29-17(27)20(18(28)30-19,9-11-3-5-13-15(7-11)23-25-21-13)10-12-4-6-14-16(8-12)24-26-22-14/h3-8H,9-10H2,1-2H3,(H,21,23,25)(H,22,24,26)