2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-1-(3-oxidanylpiperidin-1-yl)ethanone

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-1-(3-oxidanylpiperidin-1-yl)ethanone Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-1-(3-hydroxy-1-piperidyl)ethanone CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-1-(3-hydroxy-1-piperidinyl)ethanone IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-1-(3-hydroxypiperidin-1-yl)ethanone Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-1-(3-hydroxypiperidino)ethanone Formula: C15H20BrNO2S MolecularWeight: 358.2938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)N2CCCC(C2)O

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N2CCCC(C2)O

InChI

InChI=1S/C15H20BrNO2S/c1-10-7-14(11(2)6-13(10)16)20-9-15(19)17-5-3-4-12(18)8-17/h6-7,12,18H,3-5,8-9H2,1-2H3