tert-butyl N-[4-[3-(4-bromanylphenoxy)propyl]piperazin-1-yl]-N-(2-oxidanylideneethyl)carbamate

Systemtic Name: tert-butyl N-[4-[3-(4-bromanylphenoxy)propyl]piperazin-1-yl]-N-(2-oxidanylideneethyl)carbamate Openeye Name: tert-butyl N-[4-[3-(4-bromophenoxy)propyl]piperazin-1-yl]-N-(2-oxoethyl)carbamate CAS Name: N-[4-[3-(4-bromophenoxy)propyl]-1-piperazinyl]-N-(2-oxoethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[3-(4-bromophenoxy)propyl]piperazin-1-yl]-N-(2-oxoethyl)carbamate Traditional Name: N-[4-[3-(4-bromophenoxy)propyl]piperazino]-N-(2-ketoethyl)carbamic acid tert-butyl ester Formula: C20H30BrN3O4 MolecularWeight: 456.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N(CC=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C20H30BrN3O4/c1-20(2,3)28-19(26)24(14-15-25)23-12-10-22(11-13-23)9-4-16-27-18-7-5-17(21)6-8-18/h5-8,15H,4,9-14,16H2,1-3H3