5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonylmethyl]-3-methyl-isoxazole CAS Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonylmethyl]-3-methylisoxazole IUPAC Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonylmethyl]-3-methyl-isoxazole Formula: C14H14ClNO5S MolecularWeight: 343.78266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CS(=O)(=O)CC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CC1=NOC(=C1)CS(=O)(=O)CC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C14H14ClNO5S/c1-9-4-11(21-16-9)8-22(17,18)7-10-5-12(15)14-13(6-10)19-2-3-20-14/h4-6H,2-3,7-8H2,1H3