4-[(4-chloranyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid

Systemtic Name: 4-[(4-chloranyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid Openeye Name: 4-[(4-chloro-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid CAS Name: 4-[(4-chloro-2-nitrophenoxy)methyl]-2-thiophenecarboxylic acid IUPAC Name: 4-[(4-chloro-2-nitrophenoxy)methyl]thiophene-2-carboxylic acid Traditional Name: 4-[(4-chloro-2-nitro-phenoxy)methyl]-2-thenoic acid Formula: C12H8ClNO5S MolecularWeight: 313.71362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])OCC2=CSC(=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])OCC2=CSC(=C2)C(=O)O

InChI

InChI=1S/C12H8ClNO5S/c13-8-1-2-10(9(4-8)14(17)18)19-5-7-3-11(12(15)16)20-6-7/h1-4,6H,5H2,(H,15,16)