[4-(phenylmethyl)sulfonylphenyl]methyl 2-[(4-nitrophenyl)sulfonylamino]ethanoate

Systemtic Name: [4-(phenylmethyl)sulfonylphenyl]methyl 2-[(4-nitrophenyl)sulfonylamino]ethanoate Openeye Name: (4-benzylsulfonylphenyl)methyl 2-[(4-nitrophenyl)sulfonylamino]acetate CAS Name: 2-[(4-nitrophenyl)sulfonylamino]acetic acid [4-(phenylmethyl)sulfonylphenyl]methyl ester IUPAC Name: (4-benzylsulfonylphenyl)methyl 2-[(4-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-(nosylamino)acetic acid (4-benzylsulfonylbenzyl) ester Formula: C22H20N2O8S2 MolecularWeight: 504.5328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C=C2)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C=C2)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O8S2/c25-22(14-23-34(30,31)21-12-8-19(9-13-21)24(26)27)32-15-17-6-10-20(11-7-17)33(28,29)16-18-4-2-1-3-5-18/h1-13,23H,14-16H2