(2R)-2-azanyl-3-[3-bromanyl-2,5-bis(oxidanyl)phenyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[3-bromanyl-2,5-bis(oxidanyl)phenyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-amino-3-(3-bromo-2,5-dihydroxy-phenyl)sulfanyl-propanoic acid CAS Name: (2R)-2-amino-3-[(3-bromo-2,5-dihydroxyphenyl)thio]propanoic acid IUPAC Name: (2R)-2-amino-3-(3-bromo-2,5-dihydroxyphenyl)sulfanylpropanoic acid Traditional Name: (2R)-2-amino-3-[(3-bromo-2,5-dihydroxy-phenyl)thio]propionic acid Formula: C9H10BrNO4S MolecularWeight: 308.149

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1SCC(C(=O)O)N)O)Br)O

Isomeric SMILES

C1=C(C=C(C(=C1SC[C@@H](C(=O)O)N)O)Br)O

InChI

InChI=1S/C9H10BrNO4S/c10-5-1-4(12)2-7(8(5)13)16-3-6(11)9(14)15/h1-2,6,12-13H,3,11H2,(H,14,15)/t6-/m0/s1