7-[(2-bromanyl-5-cyclopentyloxy-4-methoxy-phenyl)methyl]purine

Systemtic Name: 7-[(2-bromanyl-5-cyclopentyloxy-4-methoxy-phenyl)methyl]purine Openeye Name: 7-[[2-bromo-5-(cyclopentoxy)-4-methoxy-phenyl]methyl]purine CAS Name: 7-[(2-bromo-5-cyclopentyloxy-4-methoxyphenyl)methyl]purine IUPAC Name: 7-[(2-bromo-5-cyclopentyloxy-4-methoxyphenyl)methyl]purine Traditional Name: 7-[2-bromo-5-(cyclopentoxy)-4-methoxy-benzyl]purine Formula: C18H19BrN4O2 MolecularWeight: 403.27306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)CN2C=NC3=NC=NC=C32)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)CN2C=NC3=NC=NC=C32)OC4CCCC4

InChI

InChI=1S/C18H19BrN4O2/c1-24-16-7-14(19)12(6-17(16)25-13-4-2-3-5-13)9-23-11-22-18-15(23)8-20-10-21-18/h6-8,10-11,13H,2-5,9H2,1H3