7-[(Z)-3-chloranylbut-2-enyl]-3-methyl-8-morpholin-4-yl-purine-2,6-dione

Systemtic Name: 7-[(Z)-3-chloranylbut-2-enyl]-3-methyl-8-morpholin-4-yl-purine-2,6-dione Openeye Name: 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-morpholino-purine-2,6-dione CAS Name: 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-(4-morpholinyl)purine-2,6-dione IUPAC Name: 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione Traditional Name: 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-morpholino-xanthine Formula: C14H18ClN5O3 MolecularWeight: 339.77742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(N=C1N3CCOCC3)N(C(=O)NC2=O)C)Cl

Isomeric SMILES

C/C(=C/CN1C2=C(N=C1N3CCOCC3)N(C(=O)NC2=O)C)/Cl

InChI

InChI=1S/C14H18ClN5O3/c1-9(15)3-4-20-10-11(18(2)14(22)17-12(10)21)16-13(20)19-5-7-23-8-6-19/h3H,4-8H2,1-2H3,(H,17,21,22)/b9-3-