[5-(6-aminopurin-9-yl)-2-(phenylmethoxymethyl)oxolan-3-yl]oxyphosphonamidous acid

Systemtic Name: [5-(6-aminopurin-9-yl)-2-(phenylmethoxymethyl)oxolan-3-yl]oxyphosphonamidous acid Openeye Name: [5-(6-aminopurin-9-yl)-2-(benzyloxymethyl)tetrahydrofuran-3-yl]oxyphosphonamidous acid CAS Name: [5-(6-aminopurin-9-yl)-2-(phenylmethoxymethyl)-3-oxolanyl]oxyphosphonamidous acid IUPAC Name: [5-(6-aminopurin-9-yl)-2-(phenylmethoxymethyl)oxolan-3-yl]oxyphosphonamidous acid Traditional Name: [5-adenin-9-yl-2-(benzoxymethyl)tetrahydrofuran-3-yl]oxyphosphonamidous acid Formula: C17H21N6O4P MolecularWeight: 404.360201

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COCC4=CC=CC=C4)OP(N)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COCC4=CC=CC=C4)OP(N)O

InChI

InChI=1S/C17H21N6O4P/c18-16-15-17(21-9-20-16)23(10-22-15)14-6-12(27-28(19)24)13(26-14)8-25-7-11-4-2-1-3-5-11/h1-5,9-10,12-14,24H,6-8,19H2,(H2,18,20,21)