[(2S)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-phenyl-ethyl]azanium

Systemtic Name: [(2S)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-phenyl-ethyl]azanium Openeye Name: [(2S)-2-(4-tert-butoxycarbonylpiperazin-1-yl)-2-phenyl-ethyl]ammonium CAS Name: [(2S)-2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-2-phenylethyl]ammonium IUPAC Name: [(2S)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-phenylethyl]azanium Traditional Name: [(2S)-2-(4-tert-butoxycarbonylpiperazino)-2-phenyl-ethyl]ammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(C[NH3+])C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)[C@H](C[NH3+])C2=CC=CC=C2

InChI

InChI=1S/C17H27N3O2/c1-17(2,3)22-16(21)20-11-9-19(10-12-20)15(13-18)14-7-5-4-6-8-14/h4-8,15H,9-13,18H2,1-3H3/p+1/t15-/m1/s1