2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(4-bromoanilino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-(4-bromoanilino)-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(4-bromoanilino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-(4-bromoanilino)-2-keto-ethyl]thio]propionic acid Formula: C11H12BrNO3S MolecularWeight: 318.18688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC(=O)NC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C(=O)O)SCC(=O)NC1=CC=C(C=C1)Br

InChI

InChI=1S/C11H12BrNO3S/c1-7(11(15)16)17-6-10(14)13-9-4-2-8(12)3-5-9/h2-5,7H,6H2,1H3,(H,13,14)(H,15,16)