2-(4-chloranyl-3-nitro-phenoxy)ethanoic acid

Systemtic Name: 2-(4-chloranyl-3-nitro-phenoxy)ethanoic acid Openeye Name: 2-(4-chloro-3-nitro-phenoxy)acetic acid CAS Name: 2-(4-chloro-3-nitrophenoxy)acetic acid IUPAC Name: 2-(4-chloro-3-nitrophenoxy)acetic acid Traditional Name: 2-(4-chloro-3-nitro-phenoxy)acetic acid Formula: C8H6ClNO5 MolecularWeight: 231.58994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCC(=O)O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1OCC(=O)O)[N+](=O)[O-])Cl

InChI

InChI=1S/C8H6ClNO5/c9-6-2-1-5(15-4-8(11)12)3-7(6)10(13)14/h1-3H,4H2,(H,11,12)