2-[(3,4-dimethoxyphenyl)carbonylamino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-[(3,4-dimethoxyphenyl)carbonylamino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid Openeye Name: 2-[(3,4-dimethoxybenzoyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-4-(4-fluorophenyl)-3-thiophenecarboxylic acid IUPAC Name: 2-[(3,4-dimethoxybenzoyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid Traditional Name: 4-(4-fluorophenyl)-2-(veratroylamino)-3-thenoic acid Formula: C20H16FNO5S MolecularWeight: 401.408143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)O)OC

InChI

InChI=1S/C20H16FNO5S/c1-26-15-8-5-12(9-16(15)27-2)18(23)22-19-17(20(24)25)14(10-28-19)11-3-6-13(21)7-4-11/h3-10H,1-2H3,(H,22,23)(H,24,25)