2-[[9-[4-(2-chloroethyl)phenyl]purin-6-yl]-(2-hydroxyethyl)amino]ethanol

Systemtic Name: 2-[[9-[4-(2-chloroethyl)phenyl]purin-6-yl]-(2-hydroxyethyl)amino]ethanol Openeye Name: 2-[[9-[4-(2-chloroethyl)phenyl]purin-6-yl]-(2-hydroxyethyl)amino]ethanol CAS Name: 2-[[9-[4-(2-chloroethyl)phenyl]-6-purinyl]-(2-hydroxyethyl)amino]ethanol IUPAC Name: 2-[[9-[4-(2-chloroethyl)phenyl]purin-6-yl]-(2-hydroxyethyl)amino]ethanol Traditional Name: 2-[[9-[4-(2-chloroethyl)phenyl]purin-6-yl]-(2-hydroxyethyl)amino]ethanol Formula: C17H20ClN5O2 MolecularWeight: 361.826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCl)N2C=NC3=C2N=CN=C3N(CCO)CCO

Isomeric SMILES

C1=CC(=CC=C1CCCl)N2C=NC3=C2N=CN=C3N(CCO)CCO

InChI

InChI=1S/C17H20ClN5O2/c18-6-5-13-1-3-14(4-2-13)23-12-21-15-16(19-11-20-17(15)23)22(7-9-24)8-10-25/h1-4,11-12,24-25H,5-10H2