3-bromanylpropyl 4-(2-oxidanylidene-4-phenyl-5H-1,3-oxazol-5-yl)benzenesulfonate

Systemtic Name: 3-bromanylpropyl 4-(2-oxidanylidene-4-phenyl-5H-1,3-oxazol-5-yl)benzenesulfonate Openeye Name: 3-bromopropyl 4-(2-oxo-4-phenyl-5H-oxazol-5-yl)benzenesulfonate CAS Name: 4-(2-oxo-4-phenyl-5H-oxazol-5-yl)benzenesulfonic acid 3-bromopropyl ester IUPAC Name: 3-bromopropyl 4-(2-oxo-4-phenyl-5H-1,3-oxazol-5-yl)benzenesulfonate Traditional Name: 4-(2-keto-4-phenyl-3-oxazolin-5-yl)benzenesulfonic acid 3-bromopropyl ester Formula: C18H16BrNO5S MolecularWeight: 438.29234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)OC2C3=CC=C(C=C3)S(=O)(=O)OCCCBr

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)OC2C3=CC=C(C=C3)S(=O)(=O)OCCCBr

InChI

InChI=1S/C18H16BrNO5S/c19-11-4-12-24-26(22,23)15-9-7-14(8-10-15)17-16(20-18(21)25-17)13-5-2-1-3-6-13/h1-3,5-10,17H,4,11-12H2