3-[1-(5-methylthiophen-2-yl)ethylamino]benzoic acid

Systemtic Name: 3-[1-(5-methylthiophen-2-yl)ethylamino]benzoic acid Openeye Name: 3-[1-(5-methyl-2-thienyl)ethylamino]benzoic acid CAS Name: 3-[1-(5-methyl-2-thiophenyl)ethylamino]benzoic acid IUPAC Name: 3-[1-(5-methylthiophen-2-yl)ethylamino]benzoic acid Traditional Name: 3-[1-(5-methyl-2-thienyl)ethylamino]benzoic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(C)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H15NO2S/c1-9-6-7-13(18-9)10(2)15-12-5-3-4-11(8-12)14(16)17/h3-8,10,15H,1-2H3,(H,16,17)