8-(2-hydroxyethylamino)-1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-(2-hydroxyethylamino)-1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-(2-hydroxyethylamino)-1-[(4-methoxyphenyl)methyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 8-(2-hydroxyethylamino)-1-[(4-methoxyphenyl)methyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-(2-hydroxyethylamino)-1-[(4-methoxyphenyl)methyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 8-(2-hydroxyethylamino)-3,7-dimethyl-1-p-anisyl-xanthine Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)CC3=CC=C(C=C3)OC)C

Isomeric SMILES

CN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)CC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C17H21N5O4/c1-20-13-14(19-16(20)18-8-9-23)21(2)17(25)22(15(13)24)10-11-4-6-12(26-3)7-5-11/h4-7,23H,8-10H2,1-3H3,(H,18,19)