6-chloranyl-2-ethenyl-9-(phenylmethyl)purine

Systemtic Name: 6-chloranyl-2-ethenyl-9-(phenylmethyl)purine Openeye Name: 9-benzyl-6-chloro-2-vinyl-purine CAS Name: 6-chloro-2-ethenyl-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-6-chloro-2-ethenylpurine Traditional Name: 9-benzyl-6-chloro-2-vinyl-purine Formula: C14H11ClN4 MolecularWeight: 270.71694

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=NC2=C(C(=N1)Cl)N=CN2CC3=CC=CC=C3

Isomeric SMILES

C=CC1=NC2=C(C(=N1)Cl)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C14H11ClN4/c1-2-11-17-13(15)12-14(18-11)19(9-16-12)8-10-6-4-3-5-7-10/h2-7,9H,1,8H2