tert-butyl 2-nitroso-6-phenylmethoxy-purine-9-carboxylate

Systemtic Name: tert-butyl 2-nitroso-6-phenylmethoxy-purine-9-carboxylate Openeye Name: tert-butyl 6-benzyloxy-2-nitroso-purine-9-carboxylate CAS Name: 2-nitroso-6-phenylmethoxy-9-purinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-nitroso-6-phenylmethoxypurine-9-carboxylate Traditional Name: 6-benzoxy-2-nitroso-purine-9-carboxylic acid tert-butyl ester Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=NC2=C1N=C(N=C2OCC3=CC=CC=C3)N=O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=NC2=C1N=C(N=C2OCC3=CC=CC=C3)N=O

InChI

InChI=1S/C17H17N5O4/c1-17(2,3)26-16(23)22-10-18-12-13(22)19-15(21-24)20-14(12)25-9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3