[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenyl-hex-5-en-3-yl] methanesulfonate

Systemtic Name: [(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenyl-hex-5-en-3-yl] methanesulfonate Openeye Name: 1-[(1S)-1-(tert-butoxycarbonylamino)-2-phenyl-ethyl]but-3-enyl methanesulfonate CAS Name: methanesulfonic acid [(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-phenylhex-5-en-3-yl] ester IUPAC Name: [(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylhex-5-en-3-yl] methanesulfonate Traditional Name: methanesulfonic acid 1-[(1S)-1-(tert-butoxycarbonylamino)-2-phenyl-ethyl]but-3-enyl ester Formula: C18H27NO5S MolecularWeight: 369.47568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CC=C)OS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(CC=C)OS(=O)(=O)C

InChI

InChI=1S/C18H27NO5S/c1-6-10-16(24-25(5,21)22)15(13-14-11-8-7-9-12-14)19-17(20)23-18(2,3)4/h6-9,11-12,15-16H,1,10,13H2,2-5H3,(H,19,20)/t15-,16?/m0/s1