6-(1-phenylmethoxyethenyl)-9-(phenylmethyl)purine

Systemtic Name: 6-(1-phenylmethoxyethenyl)-9-(phenylmethyl)purine Openeye Name: 9-benzyl-6-(1-benzyloxyvinyl)purine CAS Name: 6-(1-phenylmethoxyethenyl)-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-6-(1-phenylmethoxyethenyl)purine Traditional Name: 6-(1-benzoxyvinyl)-9-benzyl-purine Formula: C21H18N4O MolecularWeight: 342.39382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C2C(=NC=N1)N(C=N2)CC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C=C(C1=C2C(=NC=N1)N(C=N2)CC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O/c1-16(26-13-18-10-6-3-7-11-18)19-20-21(23-14-22-19)25(15-24-20)12-17-8-4-2-5-9-17/h2-11,14-15H,1,12-13H2