5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(2-methyl-5-nitrophenyl)sulfonylamino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(2-methyl-5-nitrophenyl)sulfonylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(2-methyl-5-nitro-phenyl)sulfonylamino]isophthalic acid Formula: C15H12N2O8S MolecularWeight: 380.32938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C15H12N2O8S/c1-8-2-3-12(17(22)23)7-13(8)26(24,25)16-11-5-9(14(18)19)4-10(6-11)15(20)21/h2-7,16H,1H3,(H,18,19)(H,20,21)