bis[4-(benzotriazol-1-ylmethyl)phenyl]methanone

Systemtic Name: bis[4-(benzotriazol-1-ylmethyl)phenyl]methanone Openeye Name: bis[4-(benzotriazol-1-ylmethyl)phenyl]methanone CAS Name: bis[4-(1-benzotriazolylmethyl)phenyl]methanone IUPAC Name: bis[4-(benzotriazol-1-ylmethyl)phenyl]methanone Traditional Name: bis[4-(benzotriazol-1-ylmethyl)phenyl]methanone Formula: C27H20N6O MolecularWeight: 444.4873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C27H20N6O/c34-27(21-13-9-19(10-14-21)17-32-25-7-3-1-5-23(25)28-30-32)22-15-11-20(12-16-22)18-33-26-8-4-2-6-24(26)29-31-33/h1-16H,17-18H2