9-[(3aR,4R,6R,6aR)-6-(4-iodanylbutyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine

Systemtic Name: 9-[(3aR,4R,6R,6aR)-6-(4-iodanylbutyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine Openeye Name: 9-[(3aR,4R,6R,6aR)-6-(4-iodobutyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine CAS Name: 9-[(3aR,4R,6R,6aR)-6-(4-iodobutyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-6-purinamine IUPAC Name: 9-[(3aR,4R,6R,6aR)-6-(4-iodobutyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine Traditional Name: [9-[(3aR,4R,6R,6aR)-6-(4-iodobutyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-yl]amine Formula: C16H22IN5O3 MolecularWeight: 459.28205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4N)CCCCI)C

Isomeric SMILES

CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=NC4=C3N=CN=C4N)CCCCI)C

InChI

InChI=1S/C16H22IN5O3/c1-16(2)24-11-9(5-3-4-6-17)23-15(12(11)25-16)22-8-21-10-13(18)19-7-20-14(10)22/h7-9,11-12,15H,3-6H2,1-2H3,(H2,18,19,20)/t9-,11-,12-,15-/m1/s1