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

Systemtic Name: decyl 2-[1-(5-bromanyl-2-ethoxy-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: decyl 2-[1-(5-bromo-2-ethoxy-benzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(5-bromo-2-ethoxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid decyl ester IUPAC Name: decyl 2-[1-(5-bromo-2-ethoxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(5-bromo-2-ethoxy-benzoyl)-3-keto-piperazin-2-yl]acetic acid decyl ester Formula: C25H37BrN2O5 MolecularWeight: 525.47568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=CC(=C2)Br)OCC

Isomeric SMILES

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=CC(=C2)Br)OCC

InChI

InChI=1S/C25H37BrN2O5/c1-3-5-6-7-8-9-10-11-16-33-23(29)18-21-24(30)27-14-15-28(21)25(31)20-17-19(26)12-13-22(20)32-4-2/h12-13,17,21H,3-11,14-16,18H2,1-2H3,(H,27,30)