4-(4-propoxy-3-propyl-phenyl)sulfonyl-2-propyl-phenol

Systemtic Name: 4-(4-propoxy-3-propyl-phenyl)sulfonyl-2-propyl-phenol Openeye Name: 4-(4-propoxy-3-propyl-phenyl)sulfonyl-2-propyl-phenol CAS Name: 4-(4-propoxy-3-propylphenyl)sulfonyl-2-propylphenol IUPAC Name: 4-(4-propoxy-3-propylphenyl)sulfonyl-2-propylphenol Traditional Name: 4-(4-propoxy-3-propyl-phenyl)sulfonyl-2-propyl-phenol Formula: C21H28O4S MolecularWeight: 376.50962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)OCCC)CCC)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)OCCC)CCC)O

InChI

InChI=1S/C21H28O4S/c1-4-7-16-14-18(9-11-20(16)22)26(23,24)19-10-12-21(25-13-6-3)17(15-19)8-5-2/h9-12,14-15,22H,4-8,13H2,1-3H3