3-methyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid Openeye Name: 3-methyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid CAS Name: 3-methyl-2-[[(2-nitrophenyl)thio]amino]butanoic acid IUPAC Name: 3-methyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid Traditional Name: 3-methyl-2-[[(2-nitrophenyl)thio]amino]butyric acid Formula: C11H14N2O4S MolecularWeight: 270.30486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NSC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)O)NSC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O4S/c1-7(2)10(11(14)15)12-18-9-6-4-3-5-8(9)13(16)17/h3-7,10,12H,1-2H3,(H,14,15)