[cyano-(4-fluoranyl-3-phenoxy-phenyl)methyl] 2-[(2-chlorophenyl)amino]-3-methyl-butanoate

Systemtic Name: [cyano-(4-fluoranyl-3-phenoxy-phenyl)methyl] 2-[(2-chlorophenyl)amino]-3-methyl-butanoate Openeye Name: [cyano-(4-fluoro-3-phenoxy-phenyl)methyl] 2-(2-chloroanilino)-3-methyl-butanoate CAS Name: 2-(2-chloroanilino)-3-methylbutanoic acid [cyano-(4-fluoro-3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(4-fluoro-3-phenoxyphenyl)methyl] 2-(2-chloroanilino)-3-methylbutanoate Traditional Name: 2-(2-chloroanilino)-3-methyl-butyric acid [cyano-(4-fluoro-3-phenoxy-phenyl)methyl] ester Formula: C25H22ClFN2O3 MolecularWeight: 452.905183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C#N)C1=CC(=C(C=C1)F)OC2=CC=CC=C2)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C(C(=O)OC(C#N)C1=CC(=C(C=C1)F)OC2=CC=CC=C2)NC3=CC=CC=C3Cl

InChI

InChI=1S/C25H22ClFN2O3/c1-16(2)24(29-21-11-7-6-10-19(21)26)25(30)32-23(15-28)17-12-13-20(27)22(14-17)31-18-8-4-3-5-9-18/h3-14,16,23-24,29H,1-2H3