tert-butyl 2-[(2-nitrophenyl)sulfonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[(2-nitrophenyl)sulfonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]ethanoate Openeye Name: tert-butyl 2-[(2-nitrophenyl)sulfonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetate CAS Name: 2-[(2-nitrophenyl)sulfonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-nitrophenyl)sulfonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetate Traditional Name: 2-[(2-nitrophenyl)sulfonyl-[3-[(2-nitrophenyl)sulfonylamino]propyl]amino]acetic acid tert-butyl ester Formula: C21H26N4O10S2 MolecularWeight: 558.58194

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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-])S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CN(CCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O10S2/c1-21(2,3)35-20(26)15-23(37(33,34)19-12-7-5-10-17(19)25(29)30)14-8-13-22-36(31,32)18-11-6-4-9-16(18)24(27)28/h4-7,9-12,22H,8,13-15H2,1-3H3