[3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl] 4-fluoranylbenzenesulfonate

Systemtic Name: [3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl] 4-fluoranylbenzenesulfonate Openeye Name: [3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl] ester IUPAC Name: [3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [3-[(3-methoxyphenoxy)methyl]indoxazen-6-yl] ester Formula: C21H16FNO6S MolecularWeight: 429.418243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC2=NOC3=C2C=CC(=C3)OS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC(=CC=C1)OCC2=NOC3=C2C=CC(=C3)OS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FNO6S/c1-26-15-3-2-4-16(11-15)27-13-20-19-10-7-17(12-21(19)28-23-20)29-30(24,25)18-8-5-14(22)6-9-18/h2-12H,13H2,1H3