tert-butyl N-[3-[5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]-2,4-dinitro-phenoxy]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]-2,4-dinitro-phenoxy]propyl]carbamate Openeye Name: tert-butyl N-[3-[5-[3-(tert-butoxycarbonylamino)propoxy]-2,4-dinitro-phenoxy]propyl]carbamate CAS Name: N-[3-[5-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propoxy]-2,4-dinitrophenoxy]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]-2,4-dinitrophenoxy]propyl]carbamate Traditional Name: N-[3-[5-[3-(tert-butoxycarbonylamino)propoxy]-2,4-dinitro-phenoxy]propyl]carbamic acid tert-butyl ester Formula: C22H34N4O10 MolecularWeight: 514.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCOC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCCCOC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34N4O10/c1-21(2,3)35-19(27)23-9-7-11-33-17-14-18(16(26(31)32)13-15(17)25(29)30)34-12-8-10-24-20(28)36-22(4,5)6/h13-14H,7-12H2,1-6H3,(H,23,27)(H,24,28)