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

Systemtic Name: 3-[(4-tert-butylphenyl)methylsulfonylmethyl]-5-methyl-1,2-oxazole Openeye Name: 3-[(4-tert-butylphenyl)methylsulfonylmethyl]-5-methyl-isoxazole CAS Name: 3-[(4-tert-butylphenyl)methylsulfonylmethyl]-5-methylisoxazole IUPAC Name: 3-[(4-tert-butylphenyl)methylsulfonylmethyl]-5-methyl-1,2-oxazole Traditional Name: 3-[(4-tert-butylbenzyl)sulfonylmethyl]-5-methyl-isoxazole Formula: C16H21NO3S MolecularWeight: 307.40784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CS(=O)(=O)CC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC(=NO1)CS(=O)(=O)CC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C16H21NO3S/c1-12-9-15(17-20-12)11-21(18,19)10-13-5-7-14(8-6-13)16(2,3)4/h5-9H,10-11H2,1-4H3