[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-bromanyl-2-chloranyl-phenoxy)butanoate

Systemtic Name: [2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-bromanyl-2-chloranyl-phenoxy)butanoate Openeye Name: [2-(2-ethylanilino)-2-oxo-ethyl] 4-(4-bromo-2-chloro-phenoxy)butanoate CAS Name: 4-(4-bromo-2-chlorophenoxy)butanoic acid [2-(2-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylanilino)-2-oxoethyl] 4-(4-bromo-2-chlorophenoxy)butanoate Traditional Name: 4-(4-bromo-2-chloro-phenoxy)butyric acid [2-(2-ethylanilino)-2-keto-ethyl] ester Formula: C20H21BrClNO4 MolecularWeight: 454.74204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)COC(=O)CCCOC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)COC(=O)CCCOC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C20H21BrClNO4/c1-2-14-6-3-4-7-17(14)23-19(24)13-27-20(25)8-5-11-26-18-10-9-15(21)12-16(18)22/h3-4,6-7,9-10,12H,2,5,8,11,13H2,1H3,(H,23,24)