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5-(2-azanyl-6-chloranyl-purin-9-yl)pentylboronic acid

5-(2-azanyl-6-chloranyl-purin-9-yl)pentylboronic acid

Systemtic Name:5-(2-azanyl-6-chloranyl-purin-9-yl)pentylboronic acid
Openeye Name:5-(2-amino-6-chloro-purin-9-yl)pentylboronic acid
CAS Name:5-(2-amino-6-chloro-9-purinyl)pentylboronic acid
IUPAC Name:5-(2-amino-6-chloropurin-9-yl)pentylboronic acid
Traditional Name:5-(2-amino-6-chloro-purin-9-yl)pentylboronic acid
Formula: C10H15BClN5O2
MolecularWeight: 283.5224
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Descriptors Computed from Structure

Canonical SMILES:

B(CCCCCN1C=NC2=C1N=C(N=C2Cl)N)(O)O


Isomeric SMILES

B(CCCCCN1C=NC2=C1N=C(N=C2Cl)N)(O)O


InChI

InChI=1S/C10H15BClN5O2/c12-8-7-9(16-10(13)15-8)17(6-14-7)5-3-1-2-4-11(18)19/h6,18-19H,1-5H2,(H2,13,15,16)


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