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

Systemtic Name: ethyl 2-[1-[2-(4-bromanyl-2-methyl-phenoxy)ethanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-[2-(4-bromo-2-methyl-phenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-bromo-2-methylphenoxy)-1-oxoethyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[2-(4-bromo-2-methylphenoxy)acetyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[2-(4-bromo-2-methyl-phenoxy)acetyl]-3-keto-piperazin-2-yl]acetic acid ethyl ester Formula: C17H21BrN2O5 MolecularWeight: 413.26304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)CC1C(=O)NCCN1C(=O)COC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C17H21BrN2O5/c1-3-24-16(22)9-13-17(23)19-6-7-20(13)15(21)10-25-14-5-4-12(18)8-11(14)2/h4-5,8,13H,3,6-7,9-10H2,1-2H3,(H,19,23)