8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione

Systemtic Name: 8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione Openeye Name: 7-allyl-8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione IUPAC Name: 8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione Traditional Name: 7-allyl-8-[bis(2-hydroxyethyl)amino]-1,3-dimethyl-xanthine Formula: C14H21N5O4 MolecularWeight: 323.34764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(CCO)CCO)CC=C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(CCO)CCO)CC=C

InChI

InChI=1S/C14H21N5O4/c1-4-5-19-10-11(16(2)14(23)17(3)12(10)22)15-13(19)18(6-8-20)7-9-21/h4,20-21H,1,5-9H2,2-3H3