3-[2-[[2,4-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[[2,4-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(2,4-dibromoanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(2,4-dibromoanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(2,4-dibromoanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(2,4-dibromoanilino)-2-keto-ethyl]thio]propionic acid Formula: C11H11Br2NO3S MolecularWeight: 397.08294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Br)NC(=O)CSCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Br)NC(=O)CSCCC(=O)O

InChI

InChI=1S/C11H11Br2NO3S/c12-7-1-2-9(8(13)5-7)14-10(15)6-18-4-3-11(16)17/h1-2,5H,3-4,6H2,(H,14,15)(H,16,17)