5-[(4-chlorophenyl)methylsulfonylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[(4-chlorophenyl)methylsulfonylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[(4-chlorophenyl)methylsulfonylmethyl]-3-methyl-isoxazole CAS Name: 5-[(4-chlorophenyl)methylsulfonylmethyl]-3-methylisoxazole IUPAC Name: 5-[(4-chlorophenyl)methylsulfonylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[(4-chlorobenzyl)sulfonylmethyl]-3-methyl-isoxazole Formula: C12H12ClNO3S MolecularWeight: 285.74658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CS(=O)(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NOC(=C1)CS(=O)(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H12ClNO3S/c1-9-6-12(17-14-9)8-18(15,16)7-10-2-4-11(13)5-3-10/h2-6H,7-8H2,1H3