tert-butyl 4-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxoethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(5-bromo-2-furoyl)amino]acetyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H24BrN3O5 MolecularWeight: 430.29356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)CNC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)CNC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C17H24BrN3O5/c1-17(2,3)26-16(24)21-8-6-11(7-9-21)20-14(22)10-19-15(23)12-4-5-13(18)25-12/h4-5,11H,6-10H2,1-3H3,(H,19,23)(H,20,22)