[(1S,2Z)-2-[(6-chloranylpurin-9-yl)methylidene]cyclopropyl]methyl ethanoate

Systemtic Name: [(1S,2Z)-2-[(6-chloranylpurin-9-yl)methylidene]cyclopropyl]methyl ethanoate Openeye Name: [(1S,2Z)-2-[(6-chloropurin-9-yl)methylene]cyclopropyl]methyl acetate CAS Name: acetic acid [(1S,2Z)-2-[(6-chloro-9-purinyl)methylidene]cyclopropyl]methyl ester IUPAC Name: [(1S,2Z)-2-[(6-chloropurin-9-yl)methylidene]cyclopropyl]methyl acetate Traditional Name: acetic acid [(1S,2Z)-2-[(6-chloropurin-9-yl)methylene]cyclopropyl]methyl ester Formula: C12H11ClN4O2 MolecularWeight: 278.69434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC1=CN2C=NC3=C2N=CN=C3Cl

Isomeric SMILES

CC(=O)OC[C@H]\1C/C1=C/N2C=NC3=C2N=CN=C3Cl

InChI

InChI=1S/C12H11ClN4O2/c1-7(18)19-4-9-2-8(9)3-17-6-16-10-11(13)14-5-15-12(10)17/h3,5-6,9H,2,4H2,1H3/b8-3-/t9-/m1/s1