[3-oxidanyl-2-[1-[4-(1-phenylethyl)phenyl]ethoxy]phenyl] hydrogen sulfate

Systemtic Name: [3-oxidanyl-2-[1-[4-(1-phenylethyl)phenyl]ethoxy]phenyl] hydrogen sulfate Openeye Name: [3-hydroxy-2-[1-[4-(1-phenylethyl)phenyl]ethoxy]phenyl] hydrogen sulfate CAS Name: sulfuric acid [3-hydroxy-2-[1-[4-(1-phenylethyl)phenyl]ethoxy]phenyl] ester IUPAC Name: [3-hydroxy-2-[1-[4-(1-phenylethyl)phenyl]ethoxy]phenyl] hydrogen sulfate Traditional Name: sulfuric acid [3-hydroxy-2-[1-[4-(1-phenylethyl)phenyl]ethoxy]phenyl] ester Formula: C22H22O6S MolecularWeight: 414.47148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC=C(C=C2)C(C)OC3=C(C=CC=C3OS(=O)(=O)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC=C(C=C2)C(C)OC3=C(C=CC=C3OS(=O)(=O)O)O

InChI

InChI=1S/C22H22O6S/c1-15(17-7-4-3-5-8-17)18-11-13-19(14-12-18)16(2)27-22-20(23)9-6-10-21(22)28-29(24,25)26/h3-16,23H,1-2H3,(H,24,25,26)