4-[(4-phenylmethoxyphenyl)methyl]phenol sulfate

Systemtic Name: 4-[(4-phenylmethoxyphenyl)methyl]phenol sulfate Openeye Name: 4-[(4-benzyloxyphenyl)methyl]phenol sulfate CAS Name: 4-[(4-phenylmethoxyphenyl)methyl]phenol sulfate IUPAC Name: 4-[(4-phenylmethoxyphenyl)methyl]phenol sulfate Traditional Name: 4-(4-benzoxybenzyl)phenol sulfate Formula: C20H18O6S-2 MolecularWeight: 386.41832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC3=CC=C(C=C3)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC3=CC=C(C=C3)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C20H18O2.H2O4S/c21-19-10-6-16(7-11-19)14-17-8-12-20(13-9-17)22-15-18-4-2-1-3-5-18;1-5(2,3)4/h1-13,21H,14-15H2;(H2,1,2,3,4)/p-2