3-[(4-chloranyl-2-nitro-phenoxy)methyl]benzoic acid

Systemtic Name: 3-[(4-chloranyl-2-nitro-phenoxy)methyl]benzoic acid Openeye Name: 3-[(4-chloro-2-nitro-phenoxy)methyl]benzoic acid CAS Name: 3-[(4-chloro-2-nitrophenoxy)methyl]benzoic acid IUPAC Name: 3-[(4-chloro-2-nitrophenoxy)methyl]benzoic acid Traditional Name: 3-[(4-chloro-2-nitro-phenoxy)methyl]benzoic acid Formula: C14H10ClNO5 MolecularWeight: 307.6859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H10ClNO5/c15-11-4-5-13(12(7-11)16(19)20)21-8-9-2-1-3-10(6-9)14(17)18/h1-7H,8H2,(H,17,18)