(4-cyanophenyl) 3-chloranyl-4,5-dimethoxy-benzoate

Systemtic Name: (4-cyanophenyl) 3-chloranyl-4,5-dimethoxy-benzoate Openeye Name: (4-cyanophenyl) 3-chloro-4,5-dimethoxy-benzoate CAS Name: 3-chloro-4,5-dimethoxybenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-chloro-4,5-dimethoxybenzoate Traditional Name: 3-chloro-4,5-dimethoxy-benzoic acid (4-cyanophenyl) ester Formula: C16H12ClNO4 MolecularWeight: 317.72378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl)OC

InChI

InChI=1S/C16H12ClNO4/c1-20-14-8-11(7-13(17)15(14)21-2)16(19)22-12-5-3-10(9-18)4-6-12/h3-8H,1-2H3