9-[(3,4-dimethoxyphenyl)methyl]purine-6-carbonitrile

Systemtic Name: 9-[(3,4-dimethoxyphenyl)methyl]purine-6-carbonitrile Openeye Name: 9-[(3,4-dimethoxyphenyl)methyl]purine-6-carbonitrile CAS Name: 9-[(3,4-dimethoxyphenyl)methyl]-6-purinecarbonitrile IUPAC Name: 9-[(3,4-dimethoxyphenyl)methyl]purine-6-carbonitrile Traditional Name: 9-veratrylpurine-6-carbonitrile Formula: C15H13N5O2 MolecularWeight: 295.29602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C=NC3=C(N=CN=C32)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C=NC3=C(N=CN=C32)C#N)OC

InChI

InChI=1S/C15H13N5O2/c1-21-12-4-3-10(5-13(12)22-2)7-20-9-19-14-11(6-16)17-8-18-15(14)20/h3-5,8-9H,7H2,1-2H3