2-[2-chloranyl-6-(phenylmethoxyamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[2-chloranyl-6-(phenylmethoxyamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(benzyloxyamino)-2-chloro-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-chloro-6-(phenylmethoxyamino)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[2-chloro-6-(phenylmethoxyamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(benzoxyamino)-2-chloro-purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H18ClN5O5 MolecularWeight: 407.80832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CONC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CONC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)Cl

InChI

InChI=1S/C17H18ClN5O5/c18-17-20-14(22-27-7-9-4-2-1-3-5-9)11-15(21-17)23(8-19-11)16-13(26)12(25)10(6-24)28-16/h1-5,8,10,12-13,16,24-26H,6-7H2,(H,20,21,22)