2-[(4-fluorophenyl)sulfonylcarbamoyl-[(4-nitrophenyl)methyl]amino]ethanoic acid

Systemtic Name: 2-[(4-fluorophenyl)sulfonylcarbamoyl-[(4-nitrophenyl)methyl]amino]ethanoic acid Openeye Name: 2-[(4-fluorophenyl)sulfonylcarbamoyl-[(4-nitrophenyl)methyl]amino]acetic acid CAS Name: 2-[[[(4-fluorophenyl)sulfonylamino]-oxomethyl]-[(4-nitrophenyl)methyl]amino]acetic acid IUPAC Name: 2-[(4-fluorophenyl)sulfonylcarbamoyl-[(4-nitrophenyl)methyl]amino]acetic acid Traditional Name: 2-[(4-fluorophenyl)sulfonylcarbamoyl-(4-nitrobenzyl)amino]acetic acid Formula: C16H14FN3O7S MolecularWeight: 411.361663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(CC(=O)O)C(=O)NS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN(CC(=O)O)C(=O)NS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H14FN3O7S/c17-12-3-7-14(8-4-12)28(26,27)18-16(23)19(10-15(21)22)9-11-1-5-13(6-2-11)20(24)25/h1-8H,9-10H2,(H,18,23)(H,21,22)