8-[(E)-1-phenylprop-1-en-2-yl]-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-[(E)-1-phenylprop-1-en-2-yl]-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-[(E)-1-methyl-2-phenyl-vinyl]-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[(E)-1-phenylprop-1-en-2-yl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-[(E)-1-phenylprop-1-en-2-yl]-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-[(E)-1-methyl-2-phenyl-vinyl]-1,3-dipropyl-7H-purine-2,6-quinone Formula: C20H24N4O2 MolecularWeight: 352.43016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(=CC3=CC=CC=C3)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)/C(=C/C3=CC=CC=C3)/C

InChI

InChI=1S/C20H24N4O2/c1-4-11-23-18-16(19(25)24(12-5-2)20(23)26)21-17(22-18)14(3)13-15-9-7-6-8-10-15/h6-10,13H,4-5,11-12H2,1-3H3,(H,21,22)/b14-13+