3-[1-(3-bromanyl-4-fluoranyl-phenyl)ethylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[1-(3-bromanyl-4-fluoranyl-phenyl)ethylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[1-(3-bromo-4-fluoro-phenyl)ethylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[1-(3-bromo-4-fluorophenyl)ethylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[1-(3-bromo-4-fluorophenyl)ethylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[1-(3-bromo-4-fluoro-phenyl)ethylamino]-3-(2-thienyl)propionic acid Formula: C15H15BrFNO2S MolecularWeight: 372.252503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Br)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)Br)NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C15H15BrFNO2S/c1-9(10-4-5-12(17)11(16)7-10)18-13(8-15(19)20)14-3-2-6-21-14/h2-7,9,13,18H,8H2,1H3,(H,19,20)