7-[(Z)-3-chloranylbut-2-enyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(Z)-3-chloranylbut-2-enyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(Z)-3-chlorobut-2-enyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(Z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(Z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[(Z)-3-chlorobut-2-enyl]-1,3-dimethyl-xanthine Formula: C11H13ClN4O2 MolecularWeight: 268.69952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C=NC2=C1C(=O)N(C(=O)N2C)C)Cl

Isomeric SMILES

C/C(=C/CN1C=NC2=C1C(=O)N(C(=O)N2C)C)/Cl

InChI

InChI=1S/C11H13ClN4O2/c1-7(12)4-5-16-6-13-9-8(16)10(17)15(3)11(18)14(9)2/h4,6H,5H2,1-3H3/b7-4-