2-azanyl-6-chloranyl-9-[(3R,5R)-5-(hydroxymethyl)oxolan-3-yl]-7-prop-2-enyl-purin-8-one

Systemtic Name: 2-azanyl-6-chloranyl-9-[(3R,5R)-5-(hydroxymethyl)oxolan-3-yl]-7-prop-2-enyl-purin-8-one Openeye Name: 7-allyl-2-amino-6-chloro-9-[(3R,5R)-5-(hydroxymethyl)tetrahydrofuran-3-yl]purin-8-one CAS Name: 2-amino-6-chloro-9-[(3R,5R)-5-(hydroxymethyl)-3-oxolanyl]-7-prop-2-enyl-8-purinone IUPAC Name: 2-amino-6-chloro-9-[(3R,5R)-5-(hydroxymethyl)oxolan-3-yl]-7-prop-2-enylpurin-8-one Traditional Name: 7-allyl-2-amino-6-chloro-9-[(3R,5R)-5-methyloltetrahydrofuran-3-yl]purin-8-one Formula: C13H16ClN5O3 MolecularWeight: 325.75084

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(N=C(N=C2Cl)N)N(C1=O)C3CC(OC3)CO

Isomeric SMILES

C=CCN1C2=C(N=C(N=C2Cl)N)N(C1=O)[C@@H]3C[C@@H](OC3)CO

InChI

InChI=1S/C13H16ClN5O3/c1-2-3-18-9-10(14)16-12(15)17-11(9)19(13(18)21)7-4-8(5-20)22-6-7/h2,7-8,20H,1,3-6H2,(H2,15,16,17)/t7-,8-/m1/s1