2-bromanyl-2-(2,6-dimethylphenyl)-1-(4-hydroxyphenyl)ethanone hydrate

Systemtic Name: 2-bromanyl-2-(2,6-dimethylphenyl)-1-(4-hydroxyphenyl)ethanone hydrate Openeye Name: 2-bromo-2-(2,6-dimethylphenyl)-1-(4-hydroxyphenyl)ethanone hydrate CAS Name: 2-bromo-2-(2,6-dimethylphenyl)-1-(4-hydroxyphenyl)ethanone hydrate IUPAC Name: 2-bromo-2-(2,6-dimethylphenyl)-1-(4-hydroxyphenyl)ethanone hydrate Traditional Name: 2-bromo-2-(2,6-dimethylphenyl)-1-(4-hydroxyphenyl)ethanone hydrate Formula: C32H32Br2O5 MolecularWeight: 656.40148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(C(=O)C2=CC=C(C=C2)O)Br.CC1=C(C(=CC=C1)C)C(C(=O)C2=CC=C(C=C2)O)Br.O

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(C(=O)C2=CC=C(C=C2)O)Br.CC1=C(C(=CC=C1)C)C(C(=O)C2=CC=C(C=C2)O)Br.O

InChI

InChI=1S/2C16H15BrO2.H2O/c2*1-10-4-3-5-11(2)14(10)15(17)16(19)12-6-8-13(18)9-7-12;/h2*3-9,15,18H,1-2H3;1H2