diethyl 2-[2-chloranyl-6-(methylamino)purin-9-yl]cyclopropane-1,1-dicarboxylate

Systemtic Name: diethyl 2-[2-chloranyl-6-(methylamino)purin-9-yl]cyclopropane-1,1-dicarboxylate Openeye Name: diethyl 2-[2-chloro-6-(methylamino)purin-9-yl]cyclopropane-1,1-dicarboxylate CAS Name: 2-[2-chloro-6-(methylamino)-9-purinyl]cyclopropane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[2-chloro-6-(methylamino)purin-9-yl]cyclopropane-1,1-dicarboxylate Traditional Name: 2-[2-chloro-6-(methylamino)purin-9-yl]cyclopropane-1,1-dicarboxylic acid diethyl ester Formula: C15H18ClN5O4 MolecularWeight: 367.78752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1N2C=NC3=C2N=C(N=C3NC)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC1N2C=NC3=C2N=C(N=C3NC)Cl)C(=O)OCC

InChI

InChI=1S/C15H18ClN5O4/c1-4-24-12(22)15(13(23)25-5-2)6-8(15)21-7-18-9-10(17-3)19-14(16)20-11(9)21/h7-8H,4-6H2,1-3H3,(H,17,19,20)