3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-3-(3-bromophenyl)propanoic acid

Systemtic Name: 3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-3-(3-bromophenyl)propanoic acid Openeye Name: 3-(3-bromophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)propanoic acid CAS Name: 3-(3-bromophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)propanoic acid IUPAC Name: 3-(3-bromophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)propanoic acid Traditional Name: 3-(3-bromophenyl)-3-(1,1-diketo-1,4-thiazinan-4-yl)propionic acid Formula: C13H16BrNO4S MolecularWeight: 362.23944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCN1C(CC(=O)O)C2=CC(=CC=C2)Br

Isomeric SMILES

C1CS(=O)(=O)CCN1C(CC(=O)O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C13H16BrNO4S/c14-11-3-1-2-10(8-11)12(9-13(16)17)15-4-6-20(18,19)7-5-15/h1-3,8,12H,4-7,9H2,(H,16,17)