6-chloranyl-9-[2-(2-phenyl-1,3-dioxan-5-yl)ethyl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[2-(2-phenyl-1,3-dioxan-5-yl)ethyl]purin-2-amine Openeye Name: 6-chloro-9-[2-(2-phenyl-1,3-dioxan-5-yl)ethyl]purin-2-amine CAS Name: 6-chloro-9-[2-(2-phenyl-1,3-dioxan-5-yl)ethyl]-2-purinamine IUPAC Name: 6-chloro-9-[2-(2-phenyl-1,3-dioxan-5-yl)ethyl]purin-2-amine Traditional Name: [6-chloro-9-[2-(2-phenyl-1,3-dioxan-5-yl)ethyl]purin-2-yl]amine Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=CC=C2)CCN3C=NC4=C3N=C(N=C4Cl)N

Isomeric SMILES

C1C(COC(O1)C2=CC=CC=C2)CCN3C=NC4=C3N=C(N=C4Cl)N

InChI

InChI=1S/C17H18ClN5O2/c18-14-13-15(22-17(19)21-14)23(10-20-13)7-6-11-8-24-16(25-9-11)12-4-2-1-3-5-12/h1-5,10-11,16H,6-9H2,(H2,19,21,22)