3-[1-(2-chlorophenyl)ethylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[1-(2-chlorophenyl)ethylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[1-(2-chlorophenyl)ethylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[1-(2-chlorophenyl)ethylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[1-(2-chlorophenyl)ethylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[1-(2-chlorophenyl)ethylamino]-3-(2-thienyl)propionic acid Formula: C15H16ClNO2S MolecularWeight: 309.81104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC(C1=CC=CC=C1Cl)NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C15H16ClNO2S/c1-10(11-5-2-3-6-12(11)16)17-13(9-15(18)19)14-7-4-8-20-14/h2-8,10,13,17H,9H2,1H3,(H,18,19)