2-phenoxy-2-phenyl-butanoic acid dihydrate

Systemtic Name: 2-phenoxy-2-phenyl-butanoic acid dihydrate Openeye Name: 2-phenoxy-2-phenyl-butanoic acid dihydrate CAS Name: 2-phenoxy-2-phenylbutanoic acid dihydrate IUPAC Name: 2-phenoxy-2-phenylbutanoic acid dihydrate Traditional Name: 2-phenoxy-2-phenyl-butyric acid dihydrate Formula: C16H20O5 MolecularWeight: 292.327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(=O)O)OC2=CC=CC=C2.O.O

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(=O)O)OC2=CC=CC=C2.O.O

InChI

InChI=1S/C16H16O3.2H2O/c1-2-16(15(17)18,13-9-5-3-6-10-13)19-14-11-7-4-8-12-14;;/h3-12H,2H2,1H3,(H,17,18);2*1H2