3-[(4-methyl-2-nitro-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-methyl-2-nitro-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-methyl-2-nitro-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(4-methyl-2-nitrophenyl)sulfonylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-methyl-2-nitrophenyl)sulfonylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(4-methyl-2-nitro-phenyl)sulfonylamino]-5-phenyl-2-thenoic acid Formula: C18H14N2O6S2 MolecularWeight: 418.44356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O6S2/c1-11-7-8-16(14(9-11)20(23)24)28(25,26)19-13-10-15(27-17(13)18(21)22)12-5-3-2-4-6-12/h2-10,19H,1H3,(H,21,22)