[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 5-bromanyl-2-ethoxy-benzenesulfonate

Systemtic Name: [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 5-bromanyl-2-ethoxy-benzenesulfonate Openeye Name: [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 5-bromo-2-ethoxy-benzenesulfonate CAS Name: 5-bromo-2-ethoxybenzenesulfonic acid [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] ester IUPAC Name: [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 5-bromo-2-ethoxybenzenesulfonate Traditional Name: 5-bromo-2-ethoxy-benzenesulfonic acid [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] ester Formula: C17H15BrN2O5S MolecularWeight: 439.2804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=CC=C(C=C2)C3=NOC(=N3)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=CC=C(C=C2)C3=NOC(=N3)C

InChI

InChI=1S/C17H15BrN2O5S/c1-3-23-15-9-6-13(18)10-16(15)26(21,22)25-14-7-4-12(5-8-14)17-19-11(2)24-20-17/h4-10H,3H2,1-2H3