butan-2-yl 2-[1-[5-bromanyl-2-(2-methoxyethoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: butan-2-yl 2-[1-[5-bromanyl-2-(2-methoxyethoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-[5-bromo-2-(2-methoxyethoxy)benzoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[5-bromo-2-(2-methoxyethoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-[5-bromo-2-(2-methoxyethoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[5-bromo-2-(2-methoxyethoxy)benzoyl]-3-keto-piperazin-2-yl]acetic acid sec-butyl ester Formula: C20H27BrN2O6 MolecularWeight: 471.34218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=CC(=C2)Br)OCCOC

Isomeric SMILES

CCC(C)OC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=CC(=C2)Br)OCCOC

InChI

InChI=1S/C20H27BrN2O6/c1-4-13(2)29-18(24)12-16-19(25)22-7-8-23(16)20(26)15-11-14(21)5-6-17(15)28-10-9-27-3/h5-6,11,13,16H,4,7-10,12H2,1-3H3,(H,22,25)