2-(2-azanyl-6-phenylmethoxy-purin-9-yl)ethanenitrile

Systemtic Name: 2-(2-azanyl-6-phenylmethoxy-purin-9-yl)ethanenitrile Openeye Name: 2-(2-amino-6-benzyloxy-purin-9-yl)acetonitrile CAS Name: 2-(2-amino-6-phenylmethoxy-9-purinyl)acetonitrile IUPAC Name: 2-(2-amino-6-phenylmethoxypurin-9-yl)acetonitrile Traditional Name: 2-(2-amino-6-benzoxy-purin-9-yl)acetonitrile Formula: C14H12N6O MolecularWeight: 280.28468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC(=NC3=C2N=CN3CC#N)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC3=C2N=CN3CC#N)N

InChI

InChI=1S/C14H12N6O/c15-6-7-20-9-17-11-12(20)18-14(16)19-13(11)21-8-10-4-2-1-3-5-10/h1-5,9H,7-8H2,(H2,16,18,19)