(5-iodanylfuro[3,2-b]pyridin-3-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (5-iodanylfuro[3,2-b]pyridin-3-yl)methyl 4-methylbenzenesulfonate Openeye Name: (5-iodofuro[3,2-b]pyridin-3-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5-iodo-3-furo[3,2-b]pyridinyl)methyl ester IUPAC Name: (5-iodofuro[3,2-b]pyridin-3-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5-iodofuro[3,2-b]pyridin-3-yl)methyl ester Formula: C15H12INO4S MolecularWeight: 429.22955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=COC3=C2N=C(C=C3)I

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=COC3=C2N=C(C=C3)I

InChI

InChI=1S/C15H12INO4S/c1-10-2-4-12(5-3-10)22(18,19)21-9-11-8-20-13-6-7-14(16)17-15(11)13/h2-8H,9H2,1H3