ethyl 4-[2-(4-bromanyl-3-methyl-phenoxy)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-bromanyl-3-methyl-phenoxy)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-bromo-3-methyl-phenoxy)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-bromo-3-methylphenoxy)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-bromo-3-methylphenoxy)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-bromo-3-methyl-phenoxy)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H21BrN2O4 MolecularWeight: 385.25294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)COC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C16H21BrN2O4/c1-3-22-16(21)19-8-6-18(7-9-19)15(20)11-23-13-4-5-14(17)12(2)10-13/h4-5,10H,3,6-9,11H2,1-2H3