4-[2-[3-chloranyl-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-[3-chloranyl-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[2-[4-(2-anilino-2-oxo-ethoxy)-3-chloro-phenyl]-1-cyano-vinyl]benzoic acid CAS Name: 4-[2-[4-(2-anilino-2-oxoethoxy)-3-chlorophenyl]-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-[4-(2-anilino-2-oxoethoxy)-3-chlorophenyl]-1-cyanoethenyl]benzoic acid Traditional Name: 4-[2-[4-(2-anilino-2-keto-ethoxy)-3-chloro-phenyl]-1-cyano-vinyl]benzoic acid Formula: C24H17ClN2O4 MolecularWeight: 432.85578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C(C#N)C3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C(C#N)C3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C24H17ClN2O4/c25-21-13-16(12-19(14-26)17-7-9-18(10-8-17)24(29)30)6-11-22(21)31-15-23(28)27-20-4-2-1-3-5-20/h1-13H,15H2,(H,27,28)(H,29,30)