8-[3-[(E)-prop-1-enoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-[3-[(E)-prop-1-enoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-[3-[(E)-prop-1-enoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[3-[(E)-prop-1-enoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-[3-[(E)-prop-1-enoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-[3-[(E)-prop-1-enoxy]phenyl]-1,3-dipropyl-7H-purine-2,6-quinone Formula: C20H24N4O3 MolecularWeight: 368.42956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O3/c1-4-10-23-18-16(19(25)24(11-5-2)20(23)26)21-17(22-18)14-8-7-9-15(13-14)27-12-6-3/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,21,22)/b12-6+