6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]hexanoic acid

Systemtic Name: 6-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]hexanoic acid Openeye Name: 2-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-6-(tert-butoxycarbonylamino)hexanoic acid CAS Name: 2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid Traditional Name: 2-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-6-(tert-butoxycarbonylamino)hexanoic acid Formula: C20H30N2O6 MolecularWeight: 394.462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O6/c1-20(2,3)28-19(27)21-12-8-7-11-15(17(23)24)22-16(18(25)26)13-14-9-5-4-6-10-14/h4-6,9-10,15-16,22H,7-8,11-13H2,1-3H3,(H,21,27)(H,23,24)(H,25,26)