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

Systemtic Name: (phenylmethyl) N-[9-(2-hydroxyethyloxymethyl)-6-oxidanylidene-3H-purin-2-yl]carbamate Openeye Name: benzyl N-[9-(2-hydroxyethoxymethyl)-6-oxo-3H-purin-2-yl]carbamate CAS Name: N-[9-(2-hydroxyethoxymethyl)-6-oxo-3H-purin-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[9-(2-hydroxyethoxymethyl)-6-oxo-3H-purin-2-yl]carbamate Traditional Name: N-[9-(2-hydroxyethoxymethyl)-6-keto-3H-purin-2-yl]carbamic acid benzyl ester Formula: C16H17N5O5 MolecularWeight: 359.33668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O5/c22-6-7-25-10-21-9-17-12-13(21)18-15(19-14(12)23)20-16(24)26-8-11-4-2-1-3-5-11/h1-5,9,22H,6-8,10H2,(H2,18,19,20,23,24)