[4-(imidazol-1-ylmethyl)phenyl] 4-bromanylbenzenesulfonate

Systemtic Name: [4-(imidazol-1-ylmethyl)phenyl] 4-bromanylbenzenesulfonate Openeye Name: [4-(imidazol-1-ylmethyl)phenyl] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [4-(1-imidazolylmethyl)phenyl] ester IUPAC Name: [4-(imidazol-1-ylmethyl)phenyl] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [4-(imidazol-1-ylmethyl)phenyl] ester Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CN=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1CN2C=CN=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN2O3S/c17-14-3-7-16(8-4-14)23(20,21)22-15-5-1-13(2-6-15)11-19-10-9-18-12-19/h1-10,12H,11H2