4-(3-methoxyphenyl)sulfanyl-5-nitro-thiophene-2-carboxylic acid

Systemtic Name: 4-(3-methoxyphenyl)sulfanyl-5-nitro-thiophene-2-carboxylic acid Openeye Name: 4-(3-methoxyphenyl)sulfanyl-5-nitro-thiophene-2-carboxylic acid CAS Name: 4-[(3-methoxyphenyl)thio]-5-nitro-2-thiophenecarboxylic acid IUPAC Name: 4-(3-methoxyphenyl)sulfanyl-5-nitrothiophene-2-carboxylic acid Traditional Name: 4-[(3-methoxyphenyl)thio]-5-nitro-2-thenoic acid Formula: C12H9NO5S2 MolecularWeight: 311.33356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=C(SC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC=C1)SC2=C(SC(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO5S2/c1-18-7-3-2-4-8(5-7)19-9-6-10(12(14)15)20-11(9)13(16)17/h2-6H,1H3,(H,14,15)