ethyl (2Z)-2-[(6-azanyl-2-chloranyl-purin-9-yl)methylidene]cyclopropane-1-carboxylate

Systemtic Name: ethyl (2Z)-2-[(6-azanyl-2-chloranyl-purin-9-yl)methylidene]cyclopropane-1-carboxylate Openeye Name: ethyl (2Z)-2-[(6-amino-2-chloro-purin-9-yl)methylene]cyclopropanecarboxylate CAS Name: (2Z)-2-[(6-amino-2-chloro-9-purinyl)methylidene]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[(6-amino-2-chloropurin-9-yl)methylidene]cyclopropane-1-carboxylate Traditional Name: (2Z)-2-[(6-amino-2-chloro-purin-9-yl)methylene]cyclopropanecarboxylic acid ethyl ester Formula: C12H12ClN5O2 MolecularWeight: 293.70898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1=CN2C=NC3=C2N=C(N=C3N)Cl

Isomeric SMILES

CCOC(=O)C\1C/C1=C/N2C=NC3=C2N=C(N=C3N)Cl

InChI

InChI=1S/C12H12ClN5O2/c1-2-20-11(19)7-3-6(7)4-18-5-15-8-9(14)16-12(13)17-10(8)18/h4-5,7H,2-3H2,1H3,(H2,14,16,17)/b6-4-