methyl 4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)cyclopentene-1-carboxylate

Systemtic Name: methyl 4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)cyclopentene-1-carboxylate Openeye Name: methyl 4-(2-amino-6-oxo-3H-purin-9-yl)cyclopentene-1-carboxylate CAS Name: 4-(2-amino-6-oxo-3H-purin-9-yl)-1-cyclopentenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-amino-6-oxo-3H-purin-9-yl)cyclopentene-1-carboxylate Traditional Name: 4-(2-amino-6-keto-3H-purin-9-yl)cyclopentene-1-carboxylic acid methyl ester Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCC(C1)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

COC(=O)C1=CCC(C1)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C12H13N5O3/c1-20-11(19)6-2-3-7(4-6)17-5-14-8-9(17)15-12(13)16-10(8)18/h2,5,7H,3-4H2,1H3,(H3,13,15,16,18)