[4-(bromomethyl)-5-(1,3-oxazol-2-yl)-1,2-oxazol-3-yl] benzenesulfonate

Systemtic Name: [4-(bromomethyl)-5-(1,3-oxazol-2-yl)-1,2-oxazol-3-yl] benzenesulfonate Openeye Name: [4-(bromomethyl)-5-oxazol-2-yl-isoxazol-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [4-(bromomethyl)-5-(2-oxazolyl)-3-isoxazolyl] ester IUPAC Name: [4-(bromomethyl)-5-(1,3-oxazol-2-yl)-1,2-oxazol-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-(bromomethyl)-5-oxazol-2-yl-isoxazol-3-yl] ester Formula: C13H9BrN2O5S MolecularWeight: 385.18996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=NOC(=C2CBr)C3=NC=CO3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=NOC(=C2CBr)C3=NC=CO3

InChI

InChI=1S/C13H9BrN2O5S/c14-8-10-11(13-15-6-7-19-13)20-16-12(10)21-22(17,18)9-4-2-1-3-5-9/h1-7H,8H2