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

Systemtic Name: butan-2-yl 2-[1-(5-bromanyl-2-propan-2-yloxy-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-(5-bromo-2-isopropoxy-benzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(5-bromo-2-propan-2-yloxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-(5-bromo-2-propan-2-yloxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(5-bromo-2-isopropoxy-benzoyl)-3-keto-piperazin-2-yl]acetic acid sec-butyl ester Formula: C20H27BrN2O5 MolecularWeight: 455.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrN2O5/c1-5-13(4)28-18(24)11-16-19(25)22-8-9-23(16)20(26)15-10-14(21)6-7-17(15)27-12(2)3/h6-7,10,12-13,16H,5,8-9,11H2,1-4H3,(H,22,25)