3-methoxy-4-[[4-(1-phenylethyl)phenyl]methoxy]benzenesulfonic acid

Systemtic Name: 3-methoxy-4-[[4-(1-phenylethyl)phenyl]methoxy]benzenesulfonic acid Openeye Name: 3-methoxy-4-[[4-(1-phenylethyl)phenyl]methoxy]benzenesulfonic acid CAS Name: 3-methoxy-4-[[4-(1-phenylethyl)phenyl]methoxy]benzenesulfonic acid IUPAC Name: 3-methoxy-4-[[4-(1-phenylethyl)phenyl]methoxy]benzenesulfonic acid Traditional Name: 3-methoxy-4-[4-(1-phenylethyl)benzyl]oxy-besylic acid Formula: C22H22O5S MolecularWeight: 398.47208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC=C(C=C2)COC3=C(C=C(C=C3)S(=O)(=O)O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC=C(C=C2)COC3=C(C=C(C=C3)S(=O)(=O)O)OC

InChI

InChI=1S/C22H22O5S/c1-16(18-6-4-3-5-7-18)19-10-8-17(9-11-19)15-27-21-13-12-20(28(23,24)25)14-22(21)26-2/h3-14,16H,15H2,1-2H3,(H,23,24,25)