(3aR,5R,6S,6aR)-6-[(4-azido-3-chloranyl-phenyl)methoxy]-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole

Systemtic Name: (3aR,5R,6S,6aR)-6-[(4-azido-3-chloranyl-phenyl)methoxy]-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole Openeye Name: (3aR,5R,6S,6aR)-6-[(4-azido-3-chloro-phenyl)methoxy]-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole CAS Name: (3aR,5R,6S,6aR)-6-[(4-azido-3-chlorophenyl)methoxy]-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole IUPAC Name: (3aR,5R,6S,6aR)-6-[(4-azido-3-chlorophenyl)methoxy]-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole Traditional Name: (3aR,5R,6S,6aR)-6-(4-azido-3-chloro-benzyl)oxy-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole Formula: C19H24ClN3O6 MolecularWeight: 425.86336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)OCC4=CC(=C(C=C4)N=[N+]=[N-])Cl)C

Isomeric SMILES

CC1(OC[C@@H](O1)[C@@H]2[C@@H]([C@@H]3[C@H](O2)OC(O3)(C)C)OCC4=CC(=C(C=C4)N=[N+]=[N-])Cl)C

InChI

InChI=1S/C19H24ClN3O6/c1-18(2)25-9-13(27-18)14-15(16-17(26-14)29-19(3,4)28-16)24-8-10-5-6-12(22-23-21)11(20)7-10/h5-7,13-17H,8-9H2,1-4H3/t13-,14-,15+,16-,17-/m1/s1