2-azanyl-3-(2-chloranyl-4-nitro-phenyl)sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-(2-chloranyl-4-nitro-phenyl)sulfanyl-propanoic acid Openeye Name: 2-amino-3-(2-chloro-4-nitro-phenyl)sulfanyl-propanoic acid CAS Name: 2-amino-3-[(2-chloro-4-nitrophenyl)thio]propanoic acid IUPAC Name: 2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoic acid Traditional Name: 2-amino-3-[(2-chloro-4-nitro-phenyl)thio]propionic acid Formula: C9H9ClN2O4S MolecularWeight: 276.69676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClN2O4S/c10-6-3-5(12(15)16)1-2-8(6)17-4-7(11)9(13)14/h1-3,7H,4,11H2,(H,13,14)