(E)-N-(phenylmethyl)-2-(7H-purin-6-yl)ethenamine

Systemtic Name: (E)-N-(phenylmethyl)-2-(7H-purin-6-yl)ethenamine Openeye Name: (E)-N-benzyl-2-(7H-purin-6-yl)ethenamine CAS Name: (E)-N-(phenylmethyl)-2-(7H-purin-6-yl)ethenamine IUPAC Name: (E)-N-benzyl-2-(7H-purin-6-yl)ethenamine Traditional Name: benzyl-[(E)-2-(7H-purin-6-yl)vinyl]amine Formula: C14H13N5 MolecularWeight: 251.28652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC=CC2=C3C(=NC=N2)N=CN3

Isomeric SMILES

C1=CC=C(C=C1)CN/C=C/C2=C3C(=NC=N2)N=CN3

InChI

InChI=1S/C14H13N5/c1-2-4-11(5-3-1)8-15-7-6-12-13-14(18-9-16-12)19-10-17-13/h1-7,9-10,15H,8H2,(H,16,17,18,19)/b7-6+