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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O2/c1-3-13-23-18-17(19(25)24(14-4-2)20(23)26)21-16(22-18)12-8-11-15-9-6-5-7-10-15/h5-11H,3-4,12-14H2,1-2H3,(H,21,22)/b11-8+