6-chloranyl-9-cyclohepta-2,4,6-trien-1-yl-purine

Systemtic Name: 6-chloranyl-9-cyclohepta-2,4,6-trien-1-yl-purine Openeye Name: 6-chloro-9-cyclohepta-2,4,6-trien-1-yl-purine CAS Name: 6-chloro-9-(1-cyclohepta-2,4,6-trienyl)purine IUPAC Name: 6-chloro-9-cyclohepta-2,4,6-trien-1-ylpurine Traditional Name: 6-chloro-9-cyclohepta-2,4,6-trien-1-yl-purine Formula: C12H9ClN4 MolecularWeight: 244.67966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CC(C=C1)N2C=NC3=C2N=CN=C3Cl

Isomeric SMILES

C1=CC=CC(C=C1)N2C=NC3=C2N=CN=C3Cl

InChI

InChI=1S/C12H9ClN4/c13-11-10-12(15-7-14-11)17(8-16-10)9-5-3-1-2-4-6-9/h1-9H