5-[[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(E)-3-(3-chloranyl-4-fluoranyl-phenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Openeye Name: 5-[[(E)-3-(3-chloro-4-fluoro-phenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[(E)-3-(3-chloro-4-fluorophenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(E)-3-(3-chloro-4-fluorophenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[(E)-3-(3-chloro-4-fluoro-phenyl)acryloyl]amino]-2-thenoic acid Formula: C14H9ClFNO3S MolecularWeight: 325.742563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)NC2=CC=C(S2)C(=O)O)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1/C=C/C(=O)NC2=CC=C(S2)C(=O)O)Cl)F

InChI

InChI=1S/C14H9ClFNO3S/c15-9-7-8(1-3-10(9)16)2-5-12(18)17-13-6-4-11(21-13)14(19)20/h1-7H,(H,17,18)(H,19,20)/b5-2+