methyl 4-(7H-purin-6-yloxy)benzoate

Systemtic Name: methyl 4-(7H-purin-6-yloxy)benzoate Openeye Name: methyl 4-(7H-purin-6-yloxy)benzoate CAS Name: 4-(7H-purin-6-yloxy)benzoic acid methyl ester IUPAC Name: methyl 4-(7H-purin-6-yloxy)benzoate Traditional Name: 4-(7H-purin-6-yloxy)benzoic acid methyl ester Formula: C13H10N4O3 MolecularWeight: 270.2435

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=NC=NC3=C2NC=N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C13H10N4O3/c1-19-13(18)8-2-4-9(5-3-8)20-12-10-11(15-6-14-10)16-7-17-12/h2-7H,1H3,(H,14,15,16,17)