3-[3-(2-fluorophenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid

Systemtic Name: 3-[3-(2-fluorophenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid Openeye Name: 3-[3-(2-fluorophenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid CAS Name: 3-[[3-(2-fluorophenyl)-1-oxopropyl]amino]-5-(3-nitrophenyl)-2-thiophenecarboxylic acid IUPAC Name: 3-[3-(2-fluorophenyl)propanoylamino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid Traditional Name: 3-[3-(2-fluorophenyl)propanoylamino]-5-(3-nitrophenyl)-2-thenoic acid Formula: C20H15FN2O5S MolecularWeight: 414.406903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15FN2O5S/c21-15-7-2-1-4-12(15)8-9-18(24)22-16-11-17(29-19(16)20(25)26)13-5-3-6-14(10-13)23(27)28/h1-7,10-11H,8-9H2,(H,22,24)(H,25,26)