tert-butyl N-[4-[[2-(3-bromanylphenoxy)propanoylamino]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[[2-(3-bromanylphenoxy)propanoylamino]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[[2-(3-bromophenoxy)propanoylamino]carbamoyl]phenyl]carbamate CAS Name: N-[4-[[[2-(3-bromophenoxy)-1-oxopropyl]hydrazo]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[2-(3-bromophenoxy)propanoylamino]carbamoyl]phenyl]carbamate Traditional Name: N-[4-[[2-(3-bromophenoxy)propanoylamino]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C21H24BrN3O5 MolecularWeight: 478.33636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1=CC=C(C=C1)NC(=O)OC(C)(C)C)OC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C(=O)NNC(=O)C1=CC=C(C=C1)NC(=O)OC(C)(C)C)OC2=CC(=CC=C2)Br

InChI

InChI=1S/C21H24BrN3O5/c1-13(29-17-7-5-6-15(22)12-17)18(26)24-25-19(27)14-8-10-16(11-9-14)23-20(28)30-21(2,3)4/h5-13H,1-4H3,(H,23,28)(H,24,26)(H,25,27)