2,3-bis(1-phenylethyl)phenol sulfate

Systemtic Name: 2,3-bis(1-phenylethyl)phenol sulfate Openeye Name: 2,3-bis(1-phenylethyl)phenol sulfate CAS Name: 2,3-bis(1-phenylethyl)phenol sulfate IUPAC Name: 2,3-bis(1-phenylethyl)phenol sulfate Traditional Name: 2,3-bis(1-phenylethyl)phenol sulfate Formula: C22H22O5S-2 MolecularWeight: 398.47208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O.H2O4S/c1-16(18-10-5-3-6-11-18)20-14-9-15-21(23)22(20)17(2)19-12-7-4-8-13-19;1-5(2,3)4/h3-17,23H,1-2H3;(H2,1,2,3,4)/p-2