3-(4-chlorophenyl)-5-[(phenylmethyl)sulfonylmethyl]-1,2-oxazole

Systemtic Name: 3-(4-chlorophenyl)-5-[(phenylmethyl)sulfonylmethyl]-1,2-oxazole Openeye Name: 5-(benzylsulfonylmethyl)-3-(4-chlorophenyl)isoxazole CAS Name: 3-(4-chlorophenyl)-5-[(phenylmethyl)sulfonylmethyl]isoxazole IUPAC Name: 5-(benzylsulfonylmethyl)-3-(4-chlorophenyl)-1,2-oxazole Traditional Name: 5-(benzylsulfonylmethyl)-3-(4-chlorophenyl)isoxazole Formula: C17H14ClNO3S MolecularWeight: 347.81596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC2=CC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC2=CC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClNO3S/c18-15-8-6-14(7-9-15)17-10-16(22-19-17)12-23(20,21)11-13-4-2-1-3-5-13/h1-10H,11-12H2