2-[(2,5-dimethyl-3-nitro-phenyl)sulfonylamino]benzoate

Systemtic Name: 2-[(2,5-dimethyl-3-nitro-phenyl)sulfonylamino]benzoate Openeye Name: 2-[(2,5-dimethyl-3-nitro-phenyl)sulfonylamino]benzoate CAS Name: 2-[(2,5-dimethyl-3-nitrophenyl)sulfonylamino]benzoate IUPAC Name: 2-[(2,5-dimethyl-3-nitrophenyl)sulfonylamino]benzoate Traditional Name: 2-[(2,5-dimethyl-3-nitro-phenyl)sulfonylamino]benzoate Formula: C15H13N2O6S- MolecularWeight: 349.33852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O6S/c1-9-7-13(17(20)21)10(2)14(8-9)24(22,23)16-12-6-4-3-5-11(12)15(18)19/h3-8,16H,1-2H3,(H,18,19)/p-1