9H-fluoren-9-ylmethoxycarbonyl 6-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]-2-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: 9H-fluoren-9-ylmethoxycarbonyl 6-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]-2-(phenylmethoxycarbonylamino)hexanoate Openeye Name: 9H-fluoren-9-ylmethoxycarbonyl 2-(benzyloxycarbonylamino)-6-[6-(tert-butoxycarbonylamino)hexanoylamino]hexanoate CAS Name: 6-[[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid [9H-fluoren-9-ylmethoxy(oxo)methyl] ester IUPAC Name: 9H-fluoren-9-ylmethoxycarbonyl 6-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoylamino]-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 2-(benzyloxycarbonylamino)-6-[6-(tert-butoxycarbonylamino)hexanoylamino]hexanoic acid 9H-fluoren-9-ylmethoxycarbonyl ester Formula: C40H49N3O9 MolecularWeight: 715.83176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCC(=O)NCCCCC(C(=O)OC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCC(=O)NCCCCC(C(=O)OC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C40H49N3O9/c1-40(2,3)52-37(46)42-25-14-5-8-23-35(44)41-24-15-13-22-34(43-38(47)49-26-28-16-6-4-7-17-28)36(45)51-39(48)50-27-33-31-20-11-9-18-29(31)30-19-10-12-21-32(30)33/h4,6-7,9-12,16-21,33-34H,5,8,13-15,22-27H2,1-3H3,(H,41,44)(H,42,46)(H,43,47)