3-[2,4,5-tris(2,3-dihydrobenzotriazol-1-yl)hexan-3-yl]-1,2-dihydrobenzotriazole

Systemtic Name: 3-[2,4,5-tris(2,3-dihydrobenzotriazol-1-yl)hexan-3-yl]-1,2-dihydrobenzotriazole Openeye Name: 3-[2,3-bis(2,3-dihydrobenzotriazol-1-yl)-1-[1-(2,3-dihydrobenzotriazol-1-yl)ethyl]butyl]-1,2-dihydrobenzotriazole CAS Name: 3-[2,4,5-tris(2,3-dihydrobenzotriazol-1-yl)hexan-3-yl]-1,2-dihydrobenzotriazole IUPAC Name: 3-[2,4,5-tris(2,3-dihydrobenzotriazol-1-yl)hexan-3-yl]-1,2-dihydrobenzotriazole Traditional Name: 3-[2,3-bis(2,3-dihydrobenzotriazol-1-yl)-1-[1-(2,3-dihydrobenzotriazol-1-yl)ethyl]butyl]-1,2-dihydrobenzotriazole Formula: C30H34N12 MolecularWeight: 562.67136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C(C)N1C2=CC=CC=C2NN1)N3C4=CC=CC=C4NN3)N5C6=CC=CC=C6NN5)N7C8=CC=CC=C8NN7

Isomeric SMILES

CC(C(C(C(C)N1C2=CC=CC=C2NN1)N3C4=CC=CC=C4NN3)N5C6=CC=CC=C6NN5)N7C8=CC=CC=C8NN7

InChI

InChI=1S/C30H34N12/c1-19(39-25-15-7-3-11-21(25)31-35-39)29(41-27-17-9-5-13-23(27)33-37-41)30(42-28-18-10-6-14-24(28)34-38-42)20(2)40-26-16-8-4-12-22(26)32-36-40/h3-20,29-38H,1-2H3