9-[(4-tert-butylphenyl)methyl]-6-chloranyl-purine

Systemtic Name: 9-[(4-tert-butylphenyl)methyl]-6-chloranyl-purine Openeye Name: 9-[(4-tert-butylphenyl)methyl]-6-chloro-purine CAS Name: 9-[(4-tert-butylphenyl)methyl]-6-chloropurine IUPAC Name: 9-[(4-tert-butylphenyl)methyl]-6-chloropurine Traditional Name: 9-(4-tert-butylbenzyl)-6-chloro-purine Formula: C16H17ClN4 MolecularWeight: 300.78598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3Cl

InChI

InChI=1S/C16H17ClN4/c1-16(2,3)12-6-4-11(5-7-12)8-21-10-20-13-14(17)18-9-19-15(13)21/h4-7,9-10H,8H2,1-3H3