6-[(2R)-2-[(2-chloranyl-4-methoxy-phenoxy)methyl]pyrrolidin-1-yl]-7H-purine

Systemtic Name: 6-[(2R)-2-[(2-chloranyl-4-methoxy-phenoxy)methyl]pyrrolidin-1-yl]-7H-purine Openeye Name: 6-[(2R)-2-[(2-chloro-4-methoxy-phenoxy)methyl]pyrrolidin-1-yl]-7H-purine CAS Name: 6-[(2R)-2-[(2-chloro-4-methoxyphenoxy)methyl]-1-pyrrolidinyl]-7H-purine IUPAC Name: 6-[(2R)-2-[(2-chloro-4-methoxyphenoxy)methyl]pyrrolidin-1-yl]-7H-purine Traditional Name: 6-[(2R)-2-[(2-chloro-4-methoxy-phenoxy)methyl]pyrrolidino]-7H-purine Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2CCCN2C3=NC=NC4=C3NC=N4)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC[C@H]2CCCN2C3=NC=NC4=C3NC=N4)Cl

InChI

InChI=1S/C17H18ClN5O2/c1-24-12-4-5-14(13(18)7-12)25-8-11-3-2-6-23(11)17-15-16(20-9-19-15)21-10-22-17/h4-5,7,9-11H,2-3,6,8H2,1H3,(H,19,20,21,22)/t11-/m1/s1