(phenylmethyl) N-[6-oxidanylidene-9-(2-oxidanylideneethyl)-3H-purin-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[6-oxidanylidene-9-(2-oxidanylideneethyl)-3H-purin-2-yl]carbamate Openeye Name: benzyl N-[6-oxo-9-(2-oxoethyl)-3H-purin-2-yl]carbamate CAS Name: N-[6-oxo-9-(2-oxoethyl)-3H-purin-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[6-oxo-9-(2-oxoethyl)-3H-purin-2-yl]carbamate Traditional Name: N-[6-keto-9-(2-ketoethyl)-3H-purin-2-yl]carbamic acid benzyl ester Formula: C15H13N5O4 MolecularWeight: 327.29482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=NC(=O)C3=C(N2)N(C=N3)CC=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=NC(=O)C3=C(N2)N(C=N3)CC=O

InChI

InChI=1S/C15H13N5O4/c21-7-6-20-9-16-11-12(20)17-14(18-13(11)22)19-15(23)24-8-10-4-2-1-3-5-10/h1-5,7,9H,6,8H2,(H2,17,18,19,22,23)