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

Systemtic Name: butyl 2-[1-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: butyl 2-[1-[2-(2-bromo-4-chloro-phenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-bromo-4-chlorophenoxy)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid butyl ester IUPAC Name: butyl 2-[1-[2-(2-bromo-4-chlorophenoxy)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(2-bromo-4-chloro-phenoxy)acetyl]-3-keto-piperazin-2-yl]acetic acid butyl ester Formula: C18H22BrClN2O5 MolecularWeight: 461.73468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

CCCCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C18H22BrClN2O5/c1-2-3-8-26-17(24)10-14-18(25)21-6-7-22(14)16(23)11-27-15-5-4-12(20)9-13(15)19/h4-5,9,14H,2-3,6-8,10-11H2,1H3,(H,21,25)