2-[3-(6-chloranylpurin-9-yl)-2-oxidanylidene-pyrrolidin-1-yl]ethyl ethanoate

Systemtic Name: 2-[3-(6-chloranylpurin-9-yl)-2-oxidanylidene-pyrrolidin-1-yl]ethyl ethanoate Openeye Name: 2-[3-(6-chloropurin-9-yl)-2-oxo-pyrrolidin-1-yl]ethyl acetate CAS Name: acetic acid 2-[3-(6-chloro-9-purinyl)-2-oxo-1-pyrrolidinyl]ethyl ester IUPAC Name: 2-[3-(6-chloropurin-9-yl)-2-oxopyrrolidin-1-yl]ethyl acetate Traditional Name: acetic acid 2-[3-(6-chloropurin-9-yl)-2-keto-pyrrolidino]ethyl ester Formula: C13H14ClN5O3 MolecularWeight: 323.73496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1CCC(C1=O)N2C=NC3=C2N=CN=C3Cl

Isomeric SMILES

CC(=O)OCCN1CCC(C1=O)N2C=NC3=C2N=CN=C3Cl

InChI

InChI=1S/C13H14ClN5O3/c1-8(20)22-5-4-18-3-2-9(13(18)21)19-7-17-10-11(14)15-6-16-12(10)19/h6-7,9H,2-5H2,1H3