3-methyl-2-(3-pyridin-3-yloxypropylsulfonylmethyl)butanoic acid

Systemtic Name: 3-methyl-2-(3-pyridin-3-yloxypropylsulfonylmethyl)butanoic acid Openeye Name: 3-methyl-2-[3-(3-pyridyloxy)propylsulfonylmethyl]butanoic acid CAS Name: 3-methyl-2-[3-(3-pyridinyloxy)propylsulfonylmethyl]butanoic acid IUPAC Name: 3-methyl-2-(3-pyridin-3-yloxypropylsulfonylmethyl)butanoic acid Traditional Name: 3-methyl-2-[3-(3-pyridyloxy)propylsulfonylmethyl]butyric acid Formula: C14H21NO5S MolecularWeight: 315.38524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CS(=O)(=O)CCCOC1=CN=CC=C1)C(=O)O

Isomeric SMILES

CC(C)C(CS(=O)(=O)CCCOC1=CN=CC=C1)C(=O)O

InChI

InChI=1S/C14H21NO5S/c1-11(2)13(14(16)17)10-21(18,19)8-4-7-20-12-5-3-6-15-9-12/h3,5-6,9,11,13H,4,7-8,10H2,1-2H3,(H,16,17)