2-(4-nitrophenyl)-3-sulfanyl-propanoic acid

Systemtic Name: 2-(4-nitrophenyl)-3-sulfanyl-propanoic acid Openeye Name: 2-(4-nitrophenyl)-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-(4-nitrophenyl)propanoic acid IUPAC Name: 2-(4-nitrophenyl)-3-sulfanylpropanoic acid Traditional Name: 3-mercapto-2-(4-nitrophenyl)propionic acid Formula: C9H9NO4S MolecularWeight: 227.23706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CS)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CS)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO4S/c11-9(12)8(5-15)6-1-3-7(4-2-6)10(13)14/h1-4,8,15H,5H2,(H,11,12)