tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]ethanoate Openeye Name: tert-butyl 2-[tert-butoxycarbonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetate Traditional Name: 2-[tert-butoxycarbonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetic acid tert-butyl ester Formula: C20H31N3O8S MolecularWeight: 473.54044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)CN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C20H31N3O8S/c1-19(2,3)30-17(24)14-22(18(25)31-20(4,5)6)13-9-12-21-32(28,29)16-11-8-7-10-15(16)23(26)27/h7-8,10-11,21H,9,12-14H2,1-6H3