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

Systemtic Name: 8-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC(=C(C=C3)OCCN(C)C)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC(=C(C=C3)OCCN(C)C)OC

InChI

InChI=1S/C18H23N5O4/c1-21(2)8-9-27-12-7-6-11(10-13(12)26-5)15-19-14-16(20-15)22(3)18(25)23(4)17(14)24/h6-7,10H,8-9H2,1-5H3,(H,19,20)