ethyl 4-(2-azanyl-6-chloranyl-purin-9-yl)cyclohexene-1-carboxylate

Systemtic Name: ethyl 4-(2-azanyl-6-chloranyl-purin-9-yl)cyclohexene-1-carboxylate Openeye Name: ethyl 4-(2-amino-6-chloro-purin-9-yl)cyclohexene-1-carboxylate CAS Name: 4-(2-amino-6-chloro-9-purinyl)-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-amino-6-chloropurin-9-yl)cyclohexene-1-carboxylate Traditional Name: 4-(2-amino-6-chloro-purin-9-yl)cyclohexene-1-carboxylic acid ethyl ester Formula: C14H16ClN5O2 MolecularWeight: 321.76214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCC(CC1)N2C=NC3=C2N=C(N=C3Cl)N

Isomeric SMILES

CCOC(=O)C1=CCC(CC1)N2C=NC3=C2N=C(N=C3Cl)N

InChI

InChI=1S/C14H16ClN5O2/c1-2-22-13(21)8-3-5-9(6-4-8)20-7-17-10-11(15)18-14(16)19-12(10)20/h3,7,9H,2,4-6H2,1H3,(H2,16,18,19)