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

Systemtic Name: pentyl 2-[1-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C19H24BrClN2O5 MolecularWeight: 475.76126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24BrClN2O5/c1-2-3-4-9-27-18(25)11-15-19(26)22-7-8-23(15)17(24)12-28-16-6-5-13(21)10-14(16)20/h5-6,10,15H,2-4,7-9,11-12H2,1H3,(H,22,26)