tert-butyl 4-[2-[(5-bromanylfuran-2-yl)carbonyl-methyl-amino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(5-bromanylfuran-2-yl)carbonyl-methyl-amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[(5-bromofuran-2-carbonyl)-methyl-amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[(5-bromo-2-furanyl)-oxomethyl]-methylamino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[(5-bromofuran-2-carbonyl)-methylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(5-bromo-2-furoyl)-methyl-amino]benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H26BrN3O5 MolecularWeight: 492.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2N(C)C(=O)C3=CC=C(O3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2N(C)C(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C22H26BrN3O5/c1-22(2,3)31-21(29)26-13-11-25(12-14-26)19(27)15-7-5-6-8-16(15)24(4)20(28)17-9-10-18(23)30-17/h5-10H,11-14H2,1-4H3