ethyl 4-[3-(4-bromophenyl)-3-oxidanylidene-propyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-bromophenyl)-3-oxidanylidene-propyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-bromophenyl)-3-oxo-propyl]piperazine-1-carboxylate CAS Name: 4-[3-(4-bromophenyl)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-bromophenyl)-3-oxopropyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-bromophenyl)-3-keto-propyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H21BrN2O3 MolecularWeight: 369.25354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN2O3/c1-2-22-16(21)19-11-9-18(10-12-19)8-7-15(20)13-3-5-14(17)6-4-13/h3-6H,2,7-12H2,1H3