4-[(3-methyl-4-propan-2-yloxy-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(3-methyl-4-propan-2-yloxy-phenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(4-isopropoxy-3-methyl-phenyl)sulfonylamino]butanoic acid CAS Name: 4-[(3-methyl-4-propan-2-yloxyphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(3-methyl-4-propan-2-yloxyphenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(4-isopropoxy-3-methyl-phenyl)sulfonylamino]butyric acid Formula: C14H21NO5S MolecularWeight: 315.38524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCCCC(=O)O)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCCCC(=O)O)OC(C)C

InChI

InChI=1S/C14H21NO5S/c1-10(2)20-13-7-6-12(9-11(13)3)21(18,19)15-8-4-5-14(16)17/h6-7,9-10,15H,4-5,8H2,1-3H3,(H,16,17)