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

Systemtic Name: 5-(4-methyl-3-nitro-phenyl)thiophene-2-carboxylic acid Openeye Name: 5-(4-methyl-3-nitro-phenyl)thiophene-2-carboxylic acid CAS Name: 5-(4-methyl-3-nitrophenyl)-2-thiophenecarboxylic acid IUPAC Name: 5-(4-methyl-3-nitrophenyl)thiophene-2-carboxylic acid Traditional Name: 5-(4-methyl-3-nitro-phenyl)-2-thenoic acid Formula: C12H9NO4S MolecularWeight: 263.26916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(S2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(S2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO4S/c1-7-2-3-8(6-9(7)13(16)17)10-4-5-11(18-10)12(14)15/h2-6H,1H3,(H,14,15)