4-(2-chlorophenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]-N-pentan-2-yl-piperazin-1-amine oxide

Systemtic Name: 4-(2-chlorophenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]-N-pentan-2-yl-piperazin-1-amine oxide Openeye Name: N-tert-butoxycarbonyl-4-(2-chlorophenyl)-N-(1-methylbutyl)piperazin-1-amine oxide CAS Name: 4-(2-chlorophenyl)-N-[(2-methylpropan-2-yl)oxy-oxomethyl]-N-pentan-2-yl-1-piperazinamine oxide IUPAC Name: 4-(2-chlorophenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]-N-pentan-2-ylpiperazin-1-amine oxide Traditional Name: N-tert-butoxycarbonyl-4-(2-chlorophenyl)-N-(1-methylbutyl)piperazin-1-amine oxide Formula: C20H32ClN3O3 MolecularWeight: 397.93938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[N+](C(=O)OC(C)(C)C)(N1CCN(CC1)C2=CC=CC=C2Cl)[O-]

Isomeric SMILES

CCCC(C)[N+](C(=O)OC(C)(C)C)(N1CCN(CC1)C2=CC=CC=C2Cl)[O-]

InChI

InChI=1S/C20H32ClN3O3/c1-6-9-16(2)24(26,19(25)27-20(3,4)5)23-14-12-22(13-15-23)18-11-8-7-10-17(18)21/h7-8,10-11,16H,6,9,12-15H2,1-5H3