(2R)-2-azanyl-3-(5-bromanyl-2-nitro-phenyl)sulfanyl-propanoic acid

Systemtic Name: (2R)-2-azanyl-3-(5-bromanyl-2-nitro-phenyl)sulfanyl-propanoic acid Openeye Name: (2R)-2-amino-3-(5-bromo-2-nitro-phenyl)sulfanyl-propanoic acid CAS Name: (2R)-2-amino-3-[(5-bromo-2-nitrophenyl)thio]propanoic acid IUPAC Name: (2R)-2-amino-3-(5-bromo-2-nitrophenyl)sulfanylpropanoic acid Traditional Name: (2R)-2-amino-3-[(5-bromo-2-nitro-phenyl)thio]propionic acid Formula: C9H9BrN2O4S MolecularWeight: 321.14776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)SCC(C(=O)O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)SC[C@@H](C(=O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C9H9BrN2O4S/c10-5-1-2-7(12(15)16)8(3-5)17-4-6(11)9(13)14/h1-3,6H,4,11H2,(H,13,14)/t6-/m0/s1