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

Systemtic Name: 2-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid Openeye Name: 2-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid CAS Name: 2-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]thiophene-3-carboxylic acid Traditional Name: 2-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]-3-thenoic acid Formula: C14H9BrFNO3S MolecularWeight: 370.193563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=CC(=O)NC2=C(C=CS2)C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1Br)/C=C/C(=O)NC2=C(C=CS2)C(=O)O)F

InChI

InChI=1S/C14H9BrFNO3S/c15-9-2-3-11(16)8(7-9)1-4-12(18)17-13-10(14(19)20)5-6-21-13/h1-7H,(H,17,18)(H,19,20)/b4-1+