tert-butyl 3-[[5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-2-nitro-phenyl]carbonylamino]propanoate

Systemtic Name: tert-butyl 3-[[5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-2-nitro-phenyl]carbonylamino]propanoate Openeye Name: tert-butyl 3-[[5-[3-(tert-butoxycarbonylamino)propanoylamino]-2-nitro-benzoyl]amino]propanoate CAS Name: 3-[[[5-[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-2-nitrophenyl]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]-2-nitrobenzoyl]amino]propanoate Traditional Name: 3-[[5-[3-(tert-butoxycarbonylamino)propanoylamino]-2-nitro-benzoyl]amino]propionic acid tert-butyl ester Formula: C22H32N4O8 MolecularWeight: 480.51148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCNC(=O)C1=C(C=CC(=C1)NC(=O)CCNC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CCNC(=O)C1=C(C=CC(=C1)NC(=O)CCNC(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H32N4O8/c1-21(2,3)33-18(28)10-12-23-19(29)15-13-14(7-8-16(15)26(31)32)25-17(27)9-11-24-20(30)34-22(4,5)6/h7-8,13H,9-12H2,1-6H3,(H,23,29)(H,24,30)(H,25,27)