5-(4-tert-butylphenyl)sulfonylpentanoic acid

Systemtic Name: 5-(4-tert-butylphenyl)sulfonylpentanoic acid Openeye Name: 5-(4-tert-butylphenyl)sulfonylpentanoic acid CAS Name: 5-(4-tert-butylphenyl)sulfonylpentanoic acid IUPAC Name: 5-(4-tert-butylphenyl)sulfonylpentanoic acid Traditional Name: 5-(4-tert-butylphenyl)sulfonylvaleric acid Formula: C15H22O4S MolecularWeight: 298.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)CCCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)CCCCC(=O)O

InChI

InChI=1S/C15H22O4S/c1-15(2,3)12-7-9-13(10-8-12)20(18,19)11-5-4-6-14(16)17/h7-10H,4-6,11H2,1-3H3,(H,16,17)