N-[9-[1,2,2-tris(chloranyl)ethenyl]purin-6-yl]benzamide

Systemtic Name: N-[9-[1,2,2-tris(chloranyl)ethenyl]purin-6-yl]benzamide Openeye Name: N-[9-(1,2,2-trichlorovinyl)purin-6-yl]benzamide CAS Name: N-[9-(1,2,2-trichloroethenyl)-6-purinyl]benzamide IUPAC Name: N-[9-(1,2,2-trichloroethenyl)purin-6-yl]benzamide Traditional Name: N-[9-(1,2,2-trichlorovinyl)purin-6-yl]benzamide Formula: C14H8Cl3N5O MolecularWeight: 368.60522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2N=CN3C(=C(Cl)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2N=CN3C(=C(Cl)Cl)Cl

InChI

InChI=1S/C14H8Cl3N5O/c15-10(16)11(17)22-7-20-9-12(18-6-19-13(9)22)21-14(23)8-4-2-1-3-5-8/h1-7H,(H,18,19,21,23)