8-phenethyl-7H-purine

Systemtic Name: 8-phenethyl-7H-purine Openeye Name: 8-phenethyl-7H-purine CAS Name: 8-phenethyl-7H-purine IUPAC Name: 8-phenethyl-7H-purine Traditional Name: 8-phenethyl-7H-purine Formula: C13H12N4 MolecularWeight: 224.26118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC3=NC=NC=C3N2

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC3=NC=NC=C3N2

InChI

InChI=1S/C13H12N4/c1-2-4-10(5-3-1)6-7-12-16-11-8-14-9-15-13(11)17-12/h1-5,8-9H,6-7H2,(H,14,15,16,17)