3-(1-thiophen-2-ylethylamino)benzoic acid

Systemtic Name: 3-(1-thiophen-2-ylethylamino)benzoic acid Openeye Name: 3-[1-(2-thienyl)ethylamino]benzoic acid CAS Name: 3-(1-thiophen-2-ylethylamino)benzoic acid IUPAC Name: 3-(1-thiophen-2-ylethylamino)benzoic acid Traditional Name: 3-[1-(2-thienyl)ethylamino]benzoic acid Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C1=CC=CS1)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C13H13NO2S/c1-9(12-6-3-7-17-12)14-11-5-2-4-10(8-11)13(15)16/h2-9,14H,1H3,(H,15,16)