2-(6-aminopurin-9-yl)-5-[(4-azanyl-3-iodanyl-phenyl)methoxymethyl]oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-5-[(4-azanyl-3-iodanyl-phenyl)methoxymethyl]oxolane-3,4-diol Openeye Name: 2-[(4-amino-3-iodo-phenyl)methoxymethyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol CAS Name: 2-[(4-amino-3-iodophenyl)methoxymethyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol IUPAC Name: 2-[(4-amino-3-iodophenyl)methoxymethyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-[(4-amino-3-iodo-benzyl)oxymethyl]tetrahydrofuran-3,4-diol Formula: C17H19IN6O4 MolecularWeight: 498.27503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1COCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O)I)N

Isomeric SMILES

C1=CC(=C(C=C1COCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O)I)N

InChI

InChI=1S/C17H19IN6O4/c18-9-3-8(1-2-10(9)19)4-27-5-11-13(25)14(26)17(28-11)24-7-23-12-15(20)21-6-22-16(12)24/h1-3,6-7,11,13-14,17,25-26H,4-5,19H2,(H2,20,21,22)