(pentanoylamino) 3-[4-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexoxy]phenyl]propanoate

Systemtic Name: (pentanoylamino) 3-[4-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexoxy]phenyl]propanoate Openeye Name: (pentanoylamino) 3-[4-[6-(tert-butoxycarbonylamino)hexoxy]phenyl]propanoate CAS Name: 3-[4-[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexoxy]phenyl]propanoic acid (1-oxopentylamino) ester IUPAC Name: (pentanoylamino) 3-[4-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hexoxy]phenyl]propanoate Traditional Name: 3-[4-[6-(tert-butoxycarbonylamino)hexoxy]phenyl]propionic acid (valerylamino) ester Formula: C25H40N2O6 MolecularWeight: 464.5949

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NOC(=O)CCC1=CC=C(C=C1)OCCCCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(=O)NOC(=O)CCC1=CC=C(C=C1)OCCCCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C25H40N2O6/c1-5-6-11-22(28)27-33-23(29)17-14-20-12-15-21(16-13-20)31-19-10-8-7-9-18-26-24(30)32-25(2,3)4/h12-13,15-16H,5-11,14,17-19H2,1-4H3,(H,26,30)(H,27,28)