(3-phenoxyphenyl) 2-chloranyl-4-nitro-benzoate

Systemtic Name: (3-phenoxyphenyl) 2-chloranyl-4-nitro-benzoate Openeye Name: (3-phenoxyphenyl) 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (3-phenoxyphenyl) ester IUPAC Name: (3-phenoxyphenyl) 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (3-phenoxyphenyl) ester Formula: C19H12ClNO5 MolecularWeight: 369.75528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC(=CC=C2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC(=CC=C2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H12ClNO5/c20-18-11-13(21(23)24)9-10-17(18)19(22)26-16-8-4-7-15(12-16)25-14-5-2-1-3-6-14/h1-12H