1,3-diethyl-8-[(E)-2-[3-methoxy-4-(methoxymethoxy)phenyl]ethenyl]-7H-purine-2,6-dione

Systemtic Name: 1,3-diethyl-8-[(E)-2-[3-methoxy-4-(methoxymethoxy)phenyl]ethenyl]-7H-purine-2,6-dione Openeye Name: 1,3-diethyl-8-[(E)-2-[3-methoxy-4-(methoxymethoxy)phenyl]vinyl]-7H-purine-2,6-dione CAS Name: 1,3-diethyl-8-[(E)-2-[3-methoxy-4-(methoxymethoxy)phenyl]ethenyl]-7H-purine-2,6-dione IUPAC Name: 1,3-diethyl-8-[(E)-2-[3-methoxy-4-(methoxymethoxy)phenyl]ethenyl]-7H-purine-2,6-dione Traditional Name: 1,3-diethyl-8-[(E)-2-[3-methoxy-4-(methoxymethoxy)phenyl]vinyl]-7H-purine-2,6-quinone Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)C=CC3=CC(=C(C=C3)OCOC)OC

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)/C=C/C3=CC(=C(C=C3)OCOC)OC

InChI

InChI=1S/C20H24N4O5/c1-5-23-18-17(19(25)24(6-2)20(23)26)21-16(22-18)10-8-13-7-9-14(29-12-27-3)15(11-13)28-4/h7-11H,5-6,12H2,1-4H3,(H,21,22)/b10-8+