2-phenoxyethyl 2-[1-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-phenoxyethyl 2-[1-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 2-phenoxyethyl 2-[1-[2-(2-bromo-4-chloro-phenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-[1-[2-(2-bromo-4-chlorophenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(2-bromo-4-chloro-phenoxy)propanoyl]-3-keto-piperazin-2-yl]acetic acid 2-phenoxyethyl ester Formula: C23H24BrClN2O6 MolecularWeight: 539.80346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCOC2=CC=CC=C2)OC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCOC2=CC=CC=C2)OC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C23H24BrClN2O6/c1-15(33-20-8-7-16(25)13-18(20)24)23(30)27-10-9-26-22(29)19(27)14-21(28)32-12-11-31-17-5-3-2-4-6-17/h2-8,13,15,19H,9-12,14H2,1H3,(H,26,29)