[3-methoxy-4-(4-oxidanylimidazo[4,5-b]pyrazin-2-yl)phenyl] methanesulfonate

Systemtic Name: [3-methoxy-4-(4-oxidanylimidazo[4,5-b]pyrazin-2-yl)phenyl] methanesulfonate Openeye Name: [4-(4-hydroxyimidazo[4,5-b]pyrazin-2-yl)-3-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-(4-hydroxy-2-imidazo[4,5-b]pyrazinyl)-3-methoxyphenyl] ester IUPAC Name: [4-(4-hydroxyimidazo[4,5-b]pyrazin-2-yl)-3-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(4-hydroxyimidazo[4,5-b]pyrazin-2-yl)-3-methoxy-phenyl] ester Formula: C13H12N4O5S MolecularWeight: 336.32318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OS(=O)(=O)C)C2=NC3=NC=CN(C3=N2)O

Isomeric SMILES

COC1=C(C=CC(=C1)OS(=O)(=O)C)C2=NC3=NC=CN(C3=N2)O

InChI

InChI=1S/C13H12N4O5S/c1-21-10-7-8(22-23(2,19)20)3-4-9(10)11-15-12-13(16-11)17(18)6-5-14-12/h3-7,18H,1-2H3