(4-nitrophenyl) 2-[4-[methyl-(2-nitrophenyl)sulfonyl-amino]phenoxy]ethanoate

Systemtic Name: (4-nitrophenyl) 2-[4-[methyl-(2-nitrophenyl)sulfonyl-amino]phenoxy]ethanoate Openeye Name: (4-nitrophenyl) 2-[4-[methyl-(2-nitrophenyl)sulfonyl-amino]phenoxy]acetate CAS Name: 2-[4-[methyl-(2-nitrophenyl)sulfonylamino]phenoxy]acetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-[4-[methyl-(2-nitrophenyl)sulfonylamino]phenoxy]acetate Traditional Name: 2-[4-[methyl-(2-nitrophenyl)sulfonyl-amino]phenoxy]acetic acid (4-nitrophenyl) ester Formula: C21H17N3O9S MolecularWeight: 487.43938

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O9S/c1-22(34(30,31)20-5-3-2-4-19(20)24(28)29)15-6-10-17(11-7-15)32-14-21(25)33-18-12-8-16(9-13-18)23(26)27/h2-13H,14H2,1H3