6-[(E)-2-(4-chlorophenyl)ethenyl]-9-(oxan-2-yl)purine

Systemtic Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-9-(oxan-2-yl)purine Openeye Name: 6-[(E)-2-(4-chlorophenyl)vinyl]-9-tetrahydropyran-2-yl-purine CAS Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-9-(2-oxanyl)purine IUPAC Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-9-(oxan-2-yl)purine Traditional Name: 6-[(E)-2-(4-chlorophenyl)vinyl]-9-tetrahydropyran-2-yl-purine Formula: C18H17ClN4O MolecularWeight: 340.80678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C=NC3=C(N=CN=C32)C=CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCOC(C1)N2C=NC3=C(N=CN=C32)/C=C/C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H17ClN4O/c19-14-7-4-13(5-8-14)6-9-15-17-18(21-11-20-15)23(12-22-17)16-3-1-2-10-24-16/h4-9,11-12,16H,1-3,10H2/b9-6+