ethyl 5-(2-azanyl-6-chloranyl-purin-9-yl)pentanoate

Systemtic Name: ethyl 5-(2-azanyl-6-chloranyl-purin-9-yl)pentanoate Openeye Name: ethyl 5-(2-amino-6-chloro-purin-9-yl)pentanoate CAS Name: 5-(2-amino-6-chloro-9-purinyl)pentanoic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-6-chloropurin-9-yl)pentanoate Traditional Name: 5-(2-amino-6-chloro-purin-9-yl)valeric acid ethyl ester Formula: C12H16ClN5O2 MolecularWeight: 297.74074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C=NC2=C1N=C(N=C2Cl)N

Isomeric SMILES

CCOC(=O)CCCCN1C=NC2=C1N=C(N=C2Cl)N

InChI

InChI=1S/C12H16ClN5O2/c1-2-20-8(19)5-3-4-6-18-7-15-9-10(13)16-12(14)17-11(9)18/h7H,2-6H2,1H3,(H2,14,16,17)