2-methoxy-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine

Systemtic Name: 2-methoxy-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine Openeye Name: 9-benzyl-2-methoxy-6-[(E)-styryl]purine CAS Name: 2-methoxy-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-2-methoxy-6-[(E)-2-phenylethenyl]purine Traditional Name: 9-benzyl-2-methoxy-6-[(E)-styryl]purine Formula: C21H18N4O MolecularWeight: 342.39382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C2C(=N1)N(C=N2)CC3=CC=CC=C3)C=CC4=CC=CC=C4

Isomeric SMILES

COC1=NC(=C2C(=N1)N(C=N2)CC3=CC=CC=C3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O/c1-26-21-23-18(13-12-16-8-4-2-5-9-16)19-20(24-21)25(15-22-19)14-17-10-6-3-7-11-17/h2-13,15H,14H2,1H3/b13-12+