tert-butyl 4-[1-(4-bromophenyl)-2-methoxy-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(4-bromophenyl)-2-methoxy-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(4-bromophenyl)-2-methoxy-2-oxo-ethyl]-3-oxo-piperazine-1-carboxylate CAS Name: 4-[1-(4-bromophenyl)-2-methoxy-2-oxoethyl]-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(4-bromophenyl)-2-methoxy-2-oxoethyl]-3-oxopiperazine-1-carboxylate Traditional Name: 4-[1-(4-bromophenyl)-2-keto-2-methoxy-ethyl]-3-keto-piperazine-1-carboxylic acid tert-butyl ester Formula: C18H23BrN2O5 MolecularWeight: 427.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1)C(C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1)C(C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C18H23BrN2O5/c1-18(2,3)26-17(24)20-9-10-21(14(22)11-20)15(16(23)25-4)12-5-7-13(19)8-6-12/h5-8,15H,9-11H2,1-4H3