2,4-bis(benzotriazol-2-yl)-5-(oxiran-2-ylmethoxy)benzene-1,3-diol

Systemtic Name: 2,4-bis(benzotriazol-2-yl)-5-(oxiran-2-ylmethoxy)benzene-1,3-diol Openeye Name: 2,4-bis(benzotriazol-2-yl)-5-(oxiran-2-ylmethoxy)benzene-1,3-diol CAS Name: 2,4-bis(2-benzotriazolyl)-5-(2-oxiranylmethoxy)benzene-1,3-diol IUPAC Name: 2,4-bis(benzotriazol-2-yl)-5-(oxiran-2-ylmethoxy)benzene-1,3-diol Traditional Name: 2,4-bis(benzotriazol-2-yl)-5-glycidoxy-resorcinol Formula: C21H16N6O4 MolecularWeight: 416.38954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)COC2=C(C(=C(C(=C2)O)N3N=C4C=CC=CC4=N3)O)N5N=C6C=CC=CC6=N5

Isomeric SMILES

C1C(O1)COC2=C(C(=C(C(=C2)O)N3N=C4C=CC=CC4=N3)O)N5N=C6C=CC=CC6=N5

InChI

InChI=1S/C21H16N6O4/c28-17-9-18(31-11-12-10-30-12)20(27-24-15-7-3-4-8-16(15)25-27)21(29)19(17)26-22-13-5-1-2-6-14(13)23-26/h1-9,12,28-29H,10-11H2