4-[4-(chloromethyl)-2-phenyl-1,3-oxazol-5-yl]benzenesulfonic acid

Systemtic Name: 4-[4-(chloromethyl)-2-phenyl-1,3-oxazol-5-yl]benzenesulfonic acid Openeye Name: 4-[4-(chloromethyl)-2-phenyl-oxazol-5-yl]benzenesulfonic acid CAS Name: 4-[4-(chloromethyl)-2-phenyl-5-oxazolyl]benzenesulfonic acid IUPAC Name: 4-[4-(chloromethyl)-2-phenyl-1,3-oxazol-5-yl]benzenesulfonic acid Traditional Name: 4-[4-(chloromethyl)-2-phenyl-oxazol-5-yl]besylic acid Formula: C16H12ClNO4S MolecularWeight: 349.78878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(O2)C3=CC=C(C=C3)S(=O)(=O)O)CCl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(O2)C3=CC=C(C=C3)S(=O)(=O)O)CCl

InChI

InChI=1S/C16H12ClNO4S/c17-10-14-15(11-6-8-13(9-7-11)23(19,20)21)22-16(18-14)12-4-2-1-3-5-12/h1-9H,10H2,(H,19,20,21)