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

Systemtic Name: 3-azanyl-3-(4-chloranyl-3-nitro-phenyl)propanoic acid Openeye Name: 3-amino-3-(4-chloro-3-nitro-phenyl)propanoic acid CAS Name: 3-amino-3-(4-chloro-3-nitrophenyl)propanoic acid IUPAC Name: 3-amino-3-(4-chloro-3-nitrophenyl)propanoic acid Traditional Name: 3-amino-3-(4-chloro-3-nitro-phenyl)propionic acid Formula: C9H9ClN2O4 MolecularWeight: 244.63176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClN2O4/c10-6-2-1-5(3-8(6)12(15)16)7(11)4-9(13)14/h1-3,7H,4,11H2,(H,13,14)