[4-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl] 4-fluoranylbenzenesulfonate

Systemtic Name: [4-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl] 4-fluoranylbenzenesulfonate Openeye Name: [4-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [4-(1,3-benzothiazol-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-benzothiazol-2-yl)-2-methoxyphenyl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [4-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl] ester Formula: C20H14FNO4S2 MolecularWeight: 415.457863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H14FNO4S2/c1-25-18-12-13(20-22-16-4-2-3-5-19(16)27-20)6-11-17(18)26-28(23,24)15-9-7-14(21)8-10-15/h2-12H,1H3