8-[4-(2-diethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[4-(2-diethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[4-(2-diethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[4-(2-diethylaminoethyloxy)-3-methoxyphenyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[4-(2-diethylaminoethyloxy)-3-methoxyphenyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[4-(2-diethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C)OC

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C)OC

InChI

InChI=1S/C20H27N5O4/c1-6-25(7-2)10-11-29-14-9-8-13(12-15(14)28-5)17-21-16-18(22-17)23(3)20(27)24(4)19(16)26/h8-9,12H,6-7,10-11H2,1-5H3,(H,21,22)